Details
Stereochemistry | ACHIRAL |
Molecular Formula | C27H35N9O5S2 |
Molecular Weight | 629.754 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCCC1=NN(C)C2=C(SC3=C(N=CN3C)[N+]([O-])=O)N=C(N=C12)C4=CC(=CC=C4OCC)S(=O)(=O)N5C[C@H](C)N[C@H](C)C5
InChI
InChIKey=BKSGUKFLKLIEQV-CALCHBBNSA-N
InChI=1S/C27H35N9O5S2/c1-7-9-20-22-23(34(6)32-20)26(42-27-25(36(37)38)28-15-33(27)5)31-24(30-22)19-12-18(10-11-21(19)41-8-2)43(39,40)35-13-16(3)29-17(4)14-35/h10-12,15-17,29H,7-9,13-14H2,1-6H3/t16-,17+
Molecular Formula | C27H35N9O5S2 |
Molecular Weight | 629.754 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:00:06 GMT 2023
by
admin
on
Sat Dec 16 10:00:06 GMT 2023
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Record UNII |
0KBR3VF526
|
Record Status |
Validated (UNII)
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Record Version |
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-
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1444244-93-2
Created by
admin on Sat Dec 16 10:00:06 GMT 2023 , Edited by admin on Sat Dec 16 10:00:06 GMT 2023
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NON-SPECIFIC STEREOCHEMISTRY | |||
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0KBR3VF526
Created by
admin on Sat Dec 16 10:00:06 GMT 2023 , Edited by admin on Sat Dec 16 10:00:06 GMT 2023
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PRIMARY | |||
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1387577-30-1
Created by
admin on Sat Dec 16 10:00:06 GMT 2023 , Edited by admin on Sat Dec 16 10:00:06 GMT 2023
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PRIMARY | |||
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54672068
Created by
admin on Sat Dec 16 10:00:06 GMT 2023 , Edited by admin on Sat Dec 16 10:00:06 GMT 2023
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PRIMARY |