[2-[(4-dimethylaminophenyl)methylamino]-2-oxidanylidene-ethyl] 2-(2,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxidanylidene-ethyl] 2-(2,4-dimethylphenyl)sulfanylethanoate Openeye Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxo-ethyl] 2-(2,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,4-dimethylphenyl)thio]acetic acid [2-[(4-dimethylaminophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-dimethylaminophenyl)methylamino]-2-oxoethyl] 2-(2,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,4-dimethylphenyl)thio]acetic acid [2-[[4-(dimethylamino)benzyl]amino]-2-keto-ethyl] ester Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)OCC(=O)NCC2=CC=C(C=C2)N(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)OCC(=O)NCC2=CC=C(C=C2)N(C)C)C

InChI

InChI=1S/C21H26N2O3S/c1-15-5-10-19(16(2)11-15)27-14-21(25)26-13-20(24)22-12-17-6-8-18(9-7-17)23(3)4/h5-11H,12-14H2,1-4H3,(H,22,24)