N-[4-(cyclohexylcarbamothioylamino)-2,5-dimethoxy-phenyl]benzamide

Systemtic Name: N-[4-(cyclohexylcarbamothioylamino)-2,5-dimethoxy-phenyl]benzamide Openeye Name: N-[4-(cyclohexylcarbamothioylamino)-2,5-dimethoxy-phenyl]benzamide CAS Name: N-[4-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-2,5-dimethoxyphenyl]benzamide IUPAC Name: N-[4-(cyclohexylcarbamothioylamino)-2,5-dimethoxyphenyl]benzamide Traditional Name: N-[4-(cyclohexylthiocarbamoylamino)-2,5-dimethoxy-phenyl]benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=S)NC3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=S)NC3CCCCC3

InChI

InChI=1S/C22H27N3O3S/c1-27-19-14-18(25-22(29)23-16-11-7-4-8-12-16)20(28-2)13-17(19)24-21(26)15-9-5-3-6-10-15/h3,5-6,9-10,13-14,16H,4,7-8,11-12H2,1-2H3,(H,24,26)(H2,23,25,29)