2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(6-pyrazol-1-ylpyridin-3-yl)benzamide

Systemtic Name: 2-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(6-pyrazol-1-ylpyridin-3-yl)benzamide Openeye Name: 2-[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]sulfanyl-N-(6-pyrazol-1-yl-3-pyridyl)benzamide CAS Name: 2-[[2-(3,4-dimethoxyanilino)-2-oxoethyl]thio]-N-[6-(1-pyrazolyl)-3-pyridinyl]benzamide IUPAC Name: 2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(6-pyrazol-1-ylpyridin-3-yl)benzamide Traditional Name: 2-[[2-(3,4-dimethoxyanilino)-2-keto-ethyl]thio]-N-(6-pyrazol-1-yl-3-pyridyl)benzamide Formula: C25H23N5O4S MolecularWeight: 489.54622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)NC3=CN=C(C=C3)N4C=CC=N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)NC3=CN=C(C=C3)N4C=CC=N4)OC

InChI

InChI=1S/C25H23N5O4S/c1-33-20-10-8-17(14-21(20)34-2)28-24(31)16-35-22-7-4-3-6-19(22)25(32)29-18-9-11-23(26-15-18)30-13-5-12-27-30/h3-15H,16H2,1-2H3,(H,28,31)(H,29,32)