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

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[cyclopentylimino-[(4,6-dimethyl-2-pyrimidinyl)amino]methyl]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[N'-cyclopentyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[N'-cyclopentyl-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(=NC2CCCC2)NC(=S)NC3=C(C(=CC=C3)Cl)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=NC2CCCC2)NC(=S)NC3=C(C(=CC=C3)Cl)C)C

InChI

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