S-[2-[[2-(methylamino)-2-oxidanylidene-ethyl]carbamoyl]phenyl] 3,4-dimethoxybenzenecarbothioate

Systemtic Name: S-[2-[[2-(methylamino)-2-oxidanylidene-ethyl]carbamoyl]phenyl] 3,4-dimethoxybenzenecarbothioate Openeye Name: S-[2-[[2-(methylamino)-2-oxo-ethyl]carbamoyl]phenyl] 3,4-dimethoxybenzenecarbothioate CAS Name: 3,4-dimethoxybenzenecarbothioic acid S-[2-[[[2-(methylamino)-2-oxoethyl]amino]-oxomethyl]phenyl] ester IUPAC Name: S-[2-[[2-(methylamino)-2-oxoethyl]carbamoyl]phenyl] 3,4-dimethoxybenzenecarbothioate Traditional Name: 3,4-dimethoxythiobenzoic acid S-[2-[[2-keto-2-(methylamino)ethyl]carbamoyl]phenyl] ester Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CNC(=O)C1=CC=CC=C1SC(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CNC(=O)CNC(=O)C1=CC=CC=C1SC(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C19H20N2O5S/c1-20-17(22)11-21-18(23)13-6-4-5-7-16(13)27-19(24)12-8-9-14(25-2)15(10-12)26-3/h4-10H,11H2,1-3H3,(H,20,22)(H,21,23)