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

Systemtic Name: 1-[3-(azepan-1-yl)propyl]-3-[1-(3,4-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea Openeye Name: 1-[3-(azepan-1-yl)propyl]-3-[1-(3,4-dimethylphenyl)-5-oxo-pyrrolidin-3-yl]urea CAS Name: 1-[3-(1-azepanyl)propyl]-3-[1-(3,4-dimethylphenyl)-5-oxo-3-pyrrolidinyl]urea IUPAC Name: 1-[3-(azepan-1-yl)propyl]-3-[1-(3,4-dimethylphenyl)-5-oxopyrrolidin-3-yl]urea Traditional Name: 1-[3-(azepan-1-yl)propyl]-3-[1-(3,4-dimethylphenyl)-5-keto-pyrrolidin-3-yl]urea Formula: C22H34N4O2 MolecularWeight: 386.53096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)NCCCN3CCCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)NCCCN3CCCCCC3)C

InChI

InChI=1S/C22H34N4O2/c1-17-8-9-20(14-18(17)2)26-16-19(15-21(26)27)24-22(28)23-10-7-13-25-11-5-3-4-6-12-25/h8-9,14,19H,3-7,10-13,15-16H2,1-2H3,(H2,23,24,28)