methyl 2-[[(4-methoxyphenyl)methyl-(2-morpholin-4-ylethyl)carbamothioyl]amino]benzoate

Systemtic Name: methyl 2-[[(4-methoxyphenyl)methyl-(2-morpholin-4-ylethyl)carbamothioyl]amino]benzoate Openeye Name: methyl 2-[[(4-methoxyphenyl)methyl-(2-morpholinoethyl)carbamothioyl]amino]benzoate CAS Name: 2-[[[(4-methoxyphenyl)methyl-[2-(4-morpholinyl)ethyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(4-methoxyphenyl)methyl-(2-morpholin-4-ylethyl)carbamothioyl]amino]benzoate Traditional Name: 2-[[2-morpholinoethyl(p-anisyl)thiocarbamoyl]amino]benzoic acid methyl ester Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CCN2CCOCC2)C(=S)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN(CCN2CCOCC2)C(=S)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C23H29N3O4S/c1-28-19-9-7-18(8-10-19)17-26(12-11-25-13-15-30-16-14-25)23(31)24-21-6-4-3-5-20(21)22(27)29-2/h3-10H,11-17H2,1-2H3,(H,24,31)