N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-cyclohexyl-carbamothioyl]-3-methoxy-benzamide

Systemtic Name: N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-cyclohexyl-carbamothioyl]-3-methoxy-benzamide Openeye Name: N-[[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl-cyclohexyl-carbamothioyl]-3-methoxy-benzamide CAS Name: N-[[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-cyclohexylamino]-sulfanylidenemethyl]-3-methoxybenzamide IUPAC Name: N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-cyclohexylcarbamothioyl]-3-methoxybenzamide Traditional Name: N-[[4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-cyclohexyl-thiocarbamoyl]-3-methoxy-benzamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(=S)N(CC2=CC(=C(C=C2)OCC(=O)N)OC)C3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC(=S)N(CC2=CC(=C(C=C2)OCC(=O)N)OC)C3CCCCC3

InChI

InChI=1S/C25H31N3O5S/c1-31-20-10-6-7-18(14-20)24(30)27-25(34)28(19-8-4-3-5-9-19)15-17-11-12-21(22(13-17)32-2)33-16-23(26)29/h6-7,10-14,19H,3-5,8-9,15-16H2,1-2H3,(H2,26,29)(H,27,30,34)