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

Systemtic Name: N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-cyclohexyl-carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl-cyclohexyl-carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-cyclohexylamino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-cyclohexylcarbamothioyl]-4-propoxybenzamide Traditional Name: N-[[4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-cyclohexyl-thiocarbamoyl]-4-propoxy-benzamide Formula: C27H35N3O5S MolecularWeight: 513.6489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)N(CC2=CC(=C(C=C2)OCC(=O)N)OC)C3CCCCC3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)N(CC2=CC(=C(C=C2)OCC(=O)N)OC)C3CCCCC3

InChI

InChI=1S/C27H35N3O5S/c1-3-15-34-22-12-10-20(11-13-22)26(32)29-27(36)30(21-7-5-4-6-8-21)17-19-9-14-23(24(16-19)33-2)35-18-25(28)31/h9-14,16,21H,3-8,15,17-18H2,1-2H3,(H2,28,31)(H,29,32,36)