1-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(2-methylphenyl)thiourea Openeye Name: 1-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(o-tolyl)thiourea CAS Name: 1-[cyclopentylimino-[(4,6-dimethyl-2-pyrimidinyl)amino]methyl]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(2-methylphenyl)thiourea Traditional Name: 1-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)amidino]-3-(o-tolyl)thiourea Formula: C20H26N6S MolecularWeight: 382.52564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NC(=NC2CCCC2)NC3=NC(=CC(=N3)C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC(=NC2CCCC2)NC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C20H26N6S/c1-13-8-4-7-11-17(13)24-20(27)26-19(23-16-9-5-6-10-16)25-18-21-14(2)12-15(3)22-18/h4,7-8,11-12,16H,5-6,9-10H2,1-3H3,(H3,21,22,23,24,25,26,27)