[4-[(E)-[3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-ethoxy-phenyl] (E)-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: [4-[(E)-[3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-ethoxy-phenyl] (E)-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: [4-[(E)-[3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-2-ethoxy-phenyl] (E)-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid [4-[(E)-[3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(E)-[3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-ethoxyphenyl] (E)-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid [2-ethoxy-4-[(E)-[4-keto-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-thioxo-thiazolidin-5-ylidene]methyl]phenyl] ester Formula: C33H29N3O6S2 MolecularWeight: 627.72986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C)OC(=O)C=CC5=CC=C(C=C5)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C)OC(=O)/C=C/C5=CC=C(C=C5)OC

InChI

InChI=1S/C33H29N3O6S2/c1-5-41-27-19-23(13-17-26(27)42-29(37)18-14-22-11-15-25(40-4)16-12-22)20-28-31(38)35(33(43)44-28)30-21(2)34(3)36(32(30)39)24-9-7-6-8-10-24/h6-20H,5H2,1-4H3/b18-14+,28-20+