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Details

Stereochemistry ABSOLUTE
Molecular Formula C31H37N7O5
Molecular Weight 587.6694
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BMS-344577

SMILES

CN(C)C(=O)C1=NC=C(C=C1)C(=O)NC(N[C@H]2CCCCN(CC(=O)N3CCCC3)C2=O)=NC4=CC=C5OC(C)=CC5=C4

InChI

InChIKey=YLSKCQOVDOZHTQ-VWLOTQADSA-N
InChI=1S/C31H37N7O5/c1-20-16-22-17-23(10-12-26(22)43-20)33-31(35-28(40)21-9-11-24(32-18-21)29(41)36(2)3)34-25-8-4-5-15-38(30(25)42)19-27(39)37-13-6-7-14-37/h9-12,16-18,25H,4-8,13-15,19H2,1-3H3,(H2,33,34,35,40)/t25-/m0/s1

HIDE SMILES / InChI

Molecular Formula C31H37N7O5
Molecular Weight 587.6694
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
U259PQB19A
Record Status Validated (UNII)
Record Version