N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]-2-sulfanylidene-1,3-thiazolidine-4-carboxamide

Systemtic Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]-2-sulfanylidene-1,3-thiazolidine-4-carboxamide Openeye Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]-2-thioxo-thiazolidine-4-carboxamide CAS Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]-4-pyrazolyl]-2-sulfanylidene-4-thiazolidinecarboxamide IUPAC Name: N-[1-[2-(3,4-dimethoxyphenyl)ethyl]pyrazol-4-yl]-2-sulfanylidene-1,3-thiazolidine-4-carboxamide Traditional Name: N-(1-homoveratrylpyrazol-4-yl)-2-thioxo-thiazolidine-4-carboxamide Formula: C17H20N4O3S2 MolecularWeight: 392.4957

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C=C(C=N2)NC(=O)C3CSC(=S)N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C=C(C=N2)NC(=O)C3CSC(=S)N3)OC

InChI

InChI=1S/C17H20N4O3S2/c1-23-14-4-3-11(7-15(14)24-2)5-6-21-9-12(8-18-21)19-16(22)13-10-26-17(25)20-13/h3-4,7-9,13H,5-6,10H2,1-2H3,(H,19,22)(H,20,25)