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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H23Cl2F2N9O2
Molecular Weight 626.444
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MILVEXIAN

SMILES

C[C@@H]1CCC[C@H](N2C=NC(=CC2=O)C3=CC(Cl)=CC=C3N4C=C(Cl)N=N4)C5=CC(=CC=N5)C6=C(NC1=O)C=NN6C(F)F

InChI

InChIKey=FSWFYCYPTDLKON-CMJOXMDJSA-N
InChI=1S/C28H23Cl2F2N9O2/c1-15-3-2-4-23(20-9-16(7-8-33-20)26-21(36-27(15)43)12-35-41(26)28(31)32)39-14-34-19(11-25(39)42)18-10-17(29)5-6-22(18)40-13-24(30)37-38-40/h5-15,23,28H,2-4H2,1H3,(H,36,43)/t15-,23+/m1/s1

HIDE SMILES / InChI

Molecular Formula C28H23Cl2F2N9O2
Molecular Weight 626.444
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
0W79NDQ608
Record Status Validated (UNII)
Record Version