4-cyano-N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-pyrrol-1-yl-furan-3-carboxamide

Systemtic Name: 4-cyano-N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-pyrrol-1-yl-furan-3-carboxamide Openeye Name: 4-cyano-N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-pyrrol-1-yl-furan-3-carboxamide CAS Name: 4-cyano-N,2-dimethyl-N-[[4-(methylthio)phenyl]methyl]-5-(1-pyrrolyl)-3-furancarboxamide IUPAC Name: 4-cyano-N,2-dimethyl-N-[(4-methylsulfanylphenyl)methyl]-5-pyrrol-1-ylfuran-3-carboxamide Traditional Name: 4-cyano-N,2-dimethyl-N-[4-(methylthio)benzyl]-5-pyrrol-1-yl-3-furamide Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N(C)CC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N(C)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C20H19N3O2S/c1-14-18(17(12-21)20(25-14)23-10-4-5-11-23)19(24)22(2)13-15-6-8-16(26-3)9-7-15/h4-11H,13H2,1-3H3