2-(3-butan-2-yl-7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-(3-chloranyl-4-fluoranyl-phenyl)ethanamide

Systemtic Name: 2-(3-butan-2-yl-7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-(3-chloranyl-4-fluoranyl-phenyl)ethanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-(7-chloro-2-oxo-5-phenyl-3-sec-butyl-3H-1,4-benzodiazepin-1-yl)acetamide CAS Name: 2-(3-butan-2-yl-7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-(3-chloro-4-fluorophenyl)acetamide IUPAC Name: 2-(3-butan-2-yl-7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-(3-chloro-4-fluorophenyl)acetamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-(7-chloro-2-keto-5-phenyl-3-sec-butyl-3H-1,4-benzodiazepin-1-yl)acetamide Formula: C27H24Cl2FN3O2 MolecularWeight: 512.402763

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CCC(C)C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C27H24Cl2FN3O2/c1-3-16(2)25-27(35)33(15-24(34)31-19-10-11-22(30)21(29)14-19)23-12-9-18(28)13-20(23)26(32-25)17-7-5-4-6-8-17/h4-14,16,25H,3,15H2,1-2H3,(H,31,34)