1-(3-methoxyphenyl)-3-[4-[(3-methoxyphenyl)carbamothioylamino]cyclohexyl]thiourea

Systemtic Name: 1-(3-methoxyphenyl)-3-[4-[(3-methoxyphenyl)carbamothioylamino]cyclohexyl]thiourea Openeye Name: 1-(3-methoxyphenyl)-3-[4-[(3-methoxyphenyl)carbamothioylamino]cyclohexyl]thiourea CAS Name: 1-[4-[[(3-methoxyanilino)-sulfanylidenemethyl]amino]cyclohexyl]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-(3-methoxyphenyl)-3-[4-[(3-methoxyphenyl)carbamothioylamino]cyclohexyl]thiourea Traditional Name: 1-(3-methoxyphenyl)-3-[4-[(3-methoxyphenyl)thiocarbamoylamino]cyclohexyl]thiourea Formula: C22H28N4O2S2 MolecularWeight: 444.61332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NC2CCC(CC2)NC(=S)NC3=CC(=CC=C3)OC

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NC2CCC(CC2)NC(=S)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H28N4O2S2/c1-27-19-7-3-5-17(13-19)25-21(29)23-15-9-11-16(12-10-15)24-22(30)26-18-6-4-8-20(14-18)28-2/h3-8,13-16H,9-12H2,1-2H3,(H2,23,25,29)(H2,24,26,30)