N-(3-chlorophenyl)-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-(3-chlorophenyl)-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1,4-diazepane-1-carboxamide Openeye Name: N-(3-chlorophenyl)-4-(2-oxo-2-pyrrolidin-1-yl-ethyl)-1,4-diazepane-1-carboxamide CAS Name: N-(3-chlorophenyl)-4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(3-chlorophenyl)-4-(2-oxo-2-pyrrolidin-1-ylethyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(3-chlorophenyl)-4-(2-keto-2-pyrrolidino-ethyl)-1,4-diazepane-1-carboxamide Formula: C18H25ClN4O2 MolecularWeight: 364.8697

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCCN(CC2)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCCN(CC2)C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H25ClN4O2/c19-15-5-3-6-16(13-15)20-18(25)23-10-4-7-21(11-12-23)14-17(24)22-8-1-2-9-22/h3,5-6,13H,1-2,4,7-12,14H2,(H,20,25)