3-[4-(2-carbamimidoylthiophen-3-yl)phenyl]-1,1-diphenyl-urea hydrochloride

Systemtic Name: 3-[4-(2-carbamimidoylthiophen-3-yl)phenyl]-1,1-diphenyl-urea hydrochloride Openeye Name: 3-[4-(2-carbamimidoyl-3-thienyl)phenyl]-1,1-diphenyl-urea hydrochloride CAS Name: 3-[4-(2-carbamimidoyl-3-thiophenyl)phenyl]-1,1-diphenylurea hydrochloride IUPAC Name: 3-[4-(2-carbamimidoylthiophen-3-yl)phenyl]-1,1-diphenylurea hydrochloride Traditional Name: 3-[4-(2-amidino-3-thienyl)phenyl]-1,1-diphenyl-urea hydrochloride Formula: C24H21ClN4OS MolecularWeight: 448.96774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C4=C(SC=C4)C(=N)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)C4=C(SC=C4)C(=N)N.Cl

InChI

InChI=1S/C24H20N4OS.ClH/c25-23(26)22-21(15-16-30-22)17-11-13-18(14-12-17)27-24(29)28(19-7-3-1-4-8-19)20-9-5-2-6-10-20;/h1-16H,(H3,25,26)(H,27,29);1H