1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]thiourea

Systemtic Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]thiourea Openeye Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]thiourea CAS Name: 1-cyclohexyl-3-[[[2-(3,4-dimethoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-cyclohexyl-3-[2-(3,4-dimethoxyphenyl)ethylcarbamothioylamino]thiourea Traditional Name: 1-cyclohexyl-3-(homoveratrylthiocarbamoylamino)thiourea Formula: C18H28N4O2S2 MolecularWeight: 396.57052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NNC(=S)NC2CCCCC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NNC(=S)NC2CCCCC2)OC

InChI

InChI=1S/C18H28N4O2S2/c1-23-15-9-8-13(12-16(15)24-2)10-11-19-17(25)21-22-18(26)20-14-6-4-3-5-7-14/h8-9,12,14H,3-7,10-11H2,1-2H3,(H2,19,21,25)(H2,20,22,26)