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

Systemtic Name: 1-(2-chlorophenyl)-3-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]thiourea Openeye Name: 1-(2-chlorophenyl)-3-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]thiourea CAS Name: 1-(2-chlorophenyl)-3-[cyclopentylimino-[(4,6-dimethyl-2-pyrimidinyl)amino]methyl]thiourea IUPAC Name: 1-(2-chlorophenyl)-3-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]thiourea Traditional Name: 1-(2-chlorophenyl)-3-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)amidino]thiourea Formula: C19H23ClN6S MolecularWeight: 402.94412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NC2CCCC2)NC(=S)NC3=CC=CC=C3Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=NC2CCCC2)NC(=S)NC3=CC=CC=C3Cl)C

InChI

InChI=1S/C19H23ClN6S/c1-12-11-13(2)22-17(21-12)25-18(23-14-7-3-4-8-14)26-19(27)24-16-10-6-5-9-15(16)20/h5-6,9-11,14H,3-4,7-8H2,1-2H3,(H3,21,22,23,24,25,26,27)