[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-morpholin-4-ylcarbothioylsulfanylethanoate

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-morpholin-4-ylcarbothioylsulfanylethanoate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 2-(morpholine-4-carbothioylsulfanyl)acetate CAS Name: 2-[[4-morpholinyl(sulfanylidene)methyl]thio]acetic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] 2-(morpholine-4-carbothioylsulfanyl)acetate Traditional Name: 2-(morpholine-4-carbothioylthio)acetic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C17H22N2O4S2 MolecularWeight: 382.49758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)CSC(=S)N2CCOCC2)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)CSC(=S)N2CCOCC2)C

InChI

InChI=1S/C17H22N2O4S2/c1-12-3-4-14(9-13(12)2)18-15(20)10-23-16(21)11-25-17(24)19-5-7-22-8-6-19/h3-4,9H,5-8,10-11H2,1-2H3,(H,18,20)