methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[[[3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylcarbamothioylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[3-(3,4-dimethoxyphenyl)acryloyl]thiocarbamoylamino]-4-(p-tolyl)thiophene-3-carboxylic acid methyl ester Formula: C25H24N2O5S2 MolecularWeight: 496.59846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=S)NC(=O)C=CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=S)NC(=O)C=CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H24N2O5S2/c1-15-5-9-17(10-6-15)18-14-34-23(22(18)24(29)32-4)27-25(33)26-21(28)12-8-16-7-11-19(30-2)20(13-16)31-3/h5-14H,1-4H3,(H2,26,27,28,33)