N-(7-chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)piperidine-1-carboxamide

Systemtic Name: N-(7-chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)piperidine-1-carboxamide Openeye Name: N-(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)piperidine-1-carboxamide CAS Name: N-(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)-1-piperidinecarboxamide IUPAC Name: N-(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)piperidine-1-carboxamide Traditional Name: N-(7-chloro-2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)piperidine-1-carboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)NC2C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)NC2C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C21H21ClN4O2/c22-15-9-10-17-16(13-15)18(14-7-3-1-4-8-14)24-19(20(27)23-17)25-21(28)26-11-5-2-6-12-26/h1,3-4,7-10,13,19H,2,5-6,11-12H2,(H,23,27)(H,25,28)