ethyl 2-[(4-methoxyphenyl)carbonylcarbamothioyl-(phenylmethyl)amino]ethanoate

Systemtic Name: ethyl 2-[(4-methoxyphenyl)carbonylcarbamothioyl-(phenylmethyl)amino]ethanoate Openeye Name: ethyl 2-[benzyl-[(4-methoxybenzoyl)carbamothioyl]amino]acetate CAS Name: 2-[[[[(4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]-(phenylmethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[benzyl-[(4-methoxybenzoyl)carbamothioyl]amino]acetate Traditional Name: 2-[benzyl(p-anisoylthiocarbamoyl)amino]acetic acid ethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)CN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H22N2O4S/c1-3-26-18(23)14-22(13-15-7-5-4-6-8-15)20(27)21-19(24)16-9-11-17(25-2)12-10-16/h4-12H,3,13-14H2,1-2H3,(H,21,24,27)