methyl N-[2-[(1R)-4-methylcyclohex-3-en-1-yl]propan-2-yl]-N'-pentan-3-yl-carbamimidothioate

Systemtic Name: methyl N-[2-[(1R)-4-methylcyclohex-3-en-1-yl]propan-2-yl]-N'-pentan-3-yl-carbamimidothioate Openeye Name: 3-(1-ethylpropyl)-2-methyl-1-[1-methyl-1-[(1R)-4-methylcyclohex-3-en-1-yl]ethyl]isothiourea CAS Name: N-[2-[(1R)-4-methyl-1-cyclohex-3-enyl]propan-2-yl]-N'-pentan-3-ylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-[2-[(1R)-4-methylcyclohex-3-en-1-yl]propan-2-yl]-N'-pentan-3-ylcarbamimidothioate Traditional Name: 3-(1-ethylpropyl)-2-methyl-1-[1-methyl-1-[(1R)-4-methylcyclohex-3-en-1-yl]ethyl]isothiourea Formula: C17H32N2S MolecularWeight: 296.51438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N=C(NC(C)(C)C1CCC(=CC1)C)SC

Isomeric SMILES

CCC(CC)N=C(NC(C)(C)[C@@H]1CCC(=CC1)C)SC

InChI

InChI=1S/C17H32N2S/c1-7-15(8-2)18-16(20-6)19-17(4,5)14-11-9-13(3)10-12-14/h9,14-15H,7-8,10-12H2,1-6H3,(H,18,19)/t14-/m0/s1