4-[[(2-methoxyphenyl)carbamothioyl-[(4-methoxyphenyl)methyl]amino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[(2-methoxyphenyl)carbamothioyl-[(4-methoxyphenyl)methyl]amino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[(2-methoxyphenyl)carbamothioyl-[(4-methoxyphenyl)methyl]amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[(2-methoxyanilino)-sulfanylidenemethyl]-[(4-methoxyphenyl)methyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[(2-methoxyphenyl)carbamothioyl-[(4-methoxyphenyl)methyl]amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[(2-methoxyphenyl)thiocarbamoyl-p-anisyl-amino]methyl]cyclohexanecarboxylic acid Formula: C24H30N2O4S MolecularWeight: 442.571

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2CCC(CC2)C(=O)O)C(=S)NC3=CC=CC=C3OC

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2CCC(CC2)C(=O)O)C(=S)NC3=CC=CC=C3OC

InChI

InChI=1S/C24H30N2O4S/c1-29-20-13-9-18(10-14-20)16-26(15-17-7-11-19(12-8-17)23(27)28)24(31)25-21-5-3-4-6-22(21)30-2/h3-6,9-10,13-14,17,19H,7-8,11-12,15-16H2,1-2H3,(H,25,31)(H,27,28)