1-[3-(azepan-1-yl)propyl]-3-[1-(4-chlorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea

Systemtic Name: 1-[3-(azepan-1-yl)propyl]-3-[1-(4-chlorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea Openeye Name: 1-[3-(azepan-1-yl)propyl]-3-[1-(4-chlorophenyl)-5-oxo-pyrrolidin-3-yl]urea CAS Name: 1-[3-(1-azepanyl)propyl]-3-[1-(4-chlorophenyl)-5-oxo-3-pyrrolidinyl]urea IUPAC Name: 1-[3-(azepan-1-yl)propyl]-3-[1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]urea Traditional Name: 1-[3-(azepan-1-yl)propyl]-3-[1-(4-chlorophenyl)-5-keto-pyrrolidin-3-yl]urea Formula: C20H29ClN4O2 MolecularWeight: 392.92286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCNC(=O)NC2CC(=O)N(C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)CCCNC(=O)NC2CC(=O)N(C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H29ClN4O2/c21-16-6-8-18(9-7-16)25-15-17(14-19(25)26)23-20(27)22-10-5-13-24-11-3-1-2-4-12-24/h6-9,17H,1-5,10-15H2,(H2,22,23,27)