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

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethyl-pyrrol-2-yl]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethyl-pyrrol-2-yl]acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethyl-2-pyrrolyl]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethylpyrrol-2-yl]acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[3-cyano-1-(4-methoxyphenyl)-4,5-dimethyl-pyrrol-2-yl]acetamide Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC3=CC=CC=C3O2)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NC3=CC=CC=C3O2)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C23H20N4O3S/c1-14-15(2)27(16-8-10-17(29-3)11-9-16)22(18(14)12-24)26-21(28)13-31-23-25-19-6-4-5-7-20(19)30-23/h4-11H,13H2,1-3H3,(H,26,28)