1-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(3,5-dimethylphenyl)thiourea

Systemtic Name: 1-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(3,5-dimethylphenyl)thiourea Openeye Name: 1-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(3,5-dimethylphenyl)thiourea CAS Name: 1-[cyclohexylimino-[(4,6-dimethyl-2-pyrimidinyl)amino]methyl]-3-(3,5-dimethylphenyl)thiourea IUPAC Name: 1-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(3,5-dimethylphenyl)thiourea Traditional Name: 1-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)amidino]-3-(3,5-dimethylphenyl)thiourea Formula: C22H30N6S MolecularWeight: 410.5788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NC(=NC2CCCCC2)NC3=NC(=CC(=N3)C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NC(=NC2CCCCC2)NC3=NC(=CC(=N3)C)C)C

InChI

InChI=1S/C22H30N6S/c1-14-10-15(2)12-19(11-14)26-22(29)28-21(25-18-8-6-5-7-9-18)27-20-23-16(3)13-17(4)24-20/h10-13,18H,5-9H2,1-4H3,(H3,23,24,25,26,27,28,29)