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

Systemtic Name: 1-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(4-ethoxyphenyl)thiourea Openeye Name: 1-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(4-ethoxyphenyl)thiourea CAS Name: 1-[cyclohexylimino-[(4,6-dimethyl-2-pyrimidinyl)amino]methyl]-3-(4-ethoxyphenyl)thiourea IUPAC Name: 1-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]-3-(4-ethoxyphenyl)thiourea Traditional Name: 1-[N'-cyclohexyl-N-(4,6-dimethylpyrimidin-2-yl)amidino]-3-p-phenetyl-thiourea Formula: C22H30N6OS MolecularWeight: 426.5782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC(=NC2CCCCC2)NC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC(=NC2CCCCC2)NC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C22H30N6OS/c1-4-29-19-12-10-18(11-13-19)26-22(30)28-21(25-17-8-6-5-7-9-17)27-20-23-15(2)14-16(3)24-20/h10-14,17H,4-9H2,1-3H3,(H3,23,24,25,26,27,28,30)