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

Systemtic Name: N-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-cyclohexyl-carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: N-[[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl-cyclohexyl-carbamothioyl]-3-isobutoxy-benzamide CAS Name: N-[[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-cyclohexylamino]-sulfanylidenemethyl]-3-(2-methylpropoxy)benzamide IUPAC Name: N-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-cyclohexylcarbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: N-[[4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-cyclohexyl-thiocarbamoyl]-3-isobutoxy-benzamide Formula: C28H37N3O5S MolecularWeight: 527.67548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37N3O5S/c1-19(2)17-35-23-11-7-8-21(15-23)27(33)30-28(37)31(22-9-5-4-6-10-22)16-20-12-13-24(25(14-20)34-3)36-18-26(29)32/h7-8,11-15,19,22H,4-6,9-10,16-18H2,1-3H3,(H2,29,32)(H,30,33,37)