3-[[4-(1-carbamimidoylpyrrolidin-2-yl)phenyl]methyl]-1,1-diphenyl-urea

Systemtic Name: 3-[[4-(1-carbamimidoylpyrrolidin-2-yl)phenyl]methyl]-1,1-diphenyl-urea Openeye Name: 3-[[4-(1-carbamimidoylpyrrolidin-2-yl)phenyl]methyl]-1,1-diphenyl-urea CAS Name: 3-[[4-(1-carbamimidoyl-2-pyrrolidinyl)phenyl]methyl]-1,1-diphenylurea IUPAC Name: 3-[[4-(1-carbamimidoylpyrrolidin-2-yl)phenyl]methyl]-1,1-diphenylurea Traditional Name: 3-[4-(1-amidinopyrrolidin-2-yl)benzyl]-1,1-diphenyl-urea Formula: C25H27N5O MolecularWeight: 413.51478

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=N)N)C2=CC=C(C=C2)CNC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC(N(C1)C(=N)N)C2=CC=C(C=C2)CNC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N5O/c26-24(27)29-17-7-12-23(29)20-15-13-19(14-16-20)18-28-25(31)30(21-8-3-1-4-9-21)22-10-5-2-6-11-22/h1-6,8-11,13-16,23H,7,12,17-18H2,(H3,26,27)(H,28,31)