1-[1-(7-chloranyl-1-ethyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-methyl-butyl]cyclohexane-1-carboxamide

Systemtic Name: 1-[1-(7-chloranyl-1-ethyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-methyl-butyl]cyclohexane-1-carboxamide Openeye Name: 1-[1-(7-chloro-1-ethyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-methyl-butyl]cyclohexanecarboxamide CAS Name: 1-[1-(7-chloro-1-ethyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-methylbutyl]-1-cyclohexanecarboxamide IUPAC Name: 1-[1-(7-chloro-1-ethyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-methylbutyl]cyclohexane-1-carboxamide Traditional Name: 1-[1-(7-chloro-1-ethyl-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-methyl-butyl]cyclohexanecarboxamide Formula: C29H36ClN3O2 MolecularWeight: 494.06804

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)C(CC(C)C)C3(CCCCC3)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)C(CC(C)C)C3(CCCCC3)C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C29H36ClN3O2/c1-4-33-24-14-13-21(30)18-22(24)25(20-11-7-5-8-12-20)32-26(27(33)34)23(17-19(2)3)29(28(31)35)15-9-6-10-16-29/h5,7-8,11-14,18-19,23,26H,4,6,9-10,15-17H2,1-3H3,(H2,31,35)