N-(3,4-dimethoxyphenyl)-2-(5-pyridin-2-yl-1-pyrrol-1-yl-pyrrol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-(5-pyridin-2-yl-1-pyrrol-1-yl-pyrrol-2-yl)sulfanyl-ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[5-(2-pyridyl)-1-pyrrol-1-yl-pyrrol-2-yl]sulfanyl-acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[[5-(2-pyridinyl)-1-(1-pyrrolyl)-2-pyrrolyl]thio]acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-(5-pyridin-2-yl-1-pyrrol-1-ylpyrrol-2-yl)sulfanylacetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[[5-(2-pyridyl)-1-pyrrol-1-yl-pyrrol-2-yl]thio]acetamide Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=CC=C(N2N3C=CC=C3)C4=CC=CC=N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=CC=C(N2N3C=CC=C3)C4=CC=CC=N4)OC

InChI

InChI=1S/C23H22N4O3S/c1-29-20-10-8-17(15-21(20)30-2)25-22(28)16-31-23-11-9-19(18-7-3-4-12-24-18)27(23)26-13-5-6-14-26/h3-15H,16H2,1-2H3,(H,25,28)