2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethyl-pyrrol-2-yl]ethanamide

Systemtic Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethyl-pyrrol-2-yl]ethanamide Openeye Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethyl-pyrrol-2-yl]acetamide CAS Name: 2-(4H-3,1-benzothiazin-2-ylthio)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethyl-2-pyrrolyl]acetamide IUPAC Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethylpyrrol-2-yl]acetamide Traditional Name: 2-(4H-3,1-benzothiazin-2-ylthio)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethyl-pyrrol-2-yl]acetamide Formula: C24H22N4O2S2 MolecularWeight: 462.58708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC3=CC=CC=C3CS2)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC3=CC=CC=C3CS2)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C24H22N4O2S2/c1-15-16(2)28(18-8-10-19(30-3)11-9-18)23(20(15)12-25)27-22(29)14-32-24-26-21-7-5-4-6-17(21)13-31-24/h4-11H,13-14H2,1-3H3,(H,27,29)