4-azanyl-5-(3,4-dimethoxyphenyl)carbonyl-2-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-thiophene-3-carbonitrile

Systemtic Name: 4-azanyl-5-(3,4-dimethoxyphenyl)carbonyl-2-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-thiophene-3-carbonitrile Openeye Name: 4-amino-5-(3,4-dimethoxybenzoyl)-2-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]sulfanyl-thiophene-3-carbonitrile CAS Name: 4-amino-2-[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]thio]-5-[(3,4-dimethoxyphenyl)-oxomethyl]-3-thiophenecarbonitrile IUPAC Name: 4-amino-5-(3,4-dimethoxybenzoyl)-2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanylthiophene-3-carbonitrile Traditional Name: 4-amino-2-[[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]thio]-5-veratroyl-thiophene-3-carbonitrile Formula: C24H22N2O6S2 MolecularWeight: 498.57128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC2=C(C(=C(S2)C(=O)C3=CC(=C(C=C3)OC)OC)N)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC2=C(C(=C(S2)C(=O)C3=CC(=C(C=C3)OC)OC)N)C#N)OC

InChI

InChI=1S/C24H22N2O6S2/c1-29-17-7-5-13(9-19(17)31-3)16(27)12-33-24-15(11-25)21(26)23(34-24)22(28)14-6-8-18(30-2)20(10-14)32-4/h5-10H,12,26H2,1-4H3