2-[3-butan-2-yl-7-chloranyl-5-(2-chlorophenyl)-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[3-butan-2-yl-7-chloranyl-5-(2-chlorophenyl)-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[7-chloro-5-(2-chlorophenyl)-2-oxo-3-sec-butyl-3H-1,4-benzodiazepin-1-yl]-N-phenethyl-acetamide CAS Name: 2-[3-butan-2-yl-7-chloro-5-(2-chlorophenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]-N-phenethylacetamide IUPAC Name: 2-[3-butan-2-yl-7-chloro-5-(2-chlorophenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]-N-phenethylacetamide Traditional Name: 2-[7-chloro-5-(2-chlorophenyl)-2-keto-3-sec-butyl-3H-1,4-benzodiazepin-1-yl]-N-phenethyl-acetamide Formula: C29H29Cl2N3O2 MolecularWeight: 522.46546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3Cl)CC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CCC(C)C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3Cl)CC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C29H29Cl2N3O2/c1-3-19(2)27-29(36)34(18-26(35)32-16-15-20-9-5-4-6-10-20)25-14-13-21(30)17-23(25)28(33-27)22-11-7-8-12-24(22)31/h4-14,17,19,27H,3,15-16,18H2,1-2H3,(H,32,35)