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

Systemtic Name: 1-(2-chlorophenyl)-3-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]thiourea Openeye Name: 1-(2-chlorophenyl)-3-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]thiourea CAS Name: 1-(2-chlorophenyl)-3-[cyclohexylimino-[(4,6-dimethyl-2-pyrimidinyl)amino]methyl]thiourea IUPAC Name: 1-(2-chlorophenyl)-3-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]thiourea Traditional Name: 1-(2-chlorophenyl)-3-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)amidino]thiourea Formula: C20H25ClN6S MolecularWeight: 416.9707

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NC2CCCCC2)NC(=S)NC3=CC=CC=C3Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=NC2CCCCC2)NC(=S)NC3=CC=CC=C3Cl)C

InChI

InChI=1S/C20H25ClN6S/c1-13-12-14(2)23-18(22-13)26-19(24-15-8-4-3-5-9-15)27-20(28)25-17-11-7-6-10-16(17)21/h6-7,10-12,15H,3-5,8-9H2,1-2H3,(H3,22,23,24,25,26,27,28)