2-cyano-3-[1-methyl-5-(4-methylphenyl)pyrrol-2-yl]prop-2-enethioamide

Systemtic Name: 2-cyano-3-[1-methyl-5-(4-methylphenyl)pyrrol-2-yl]prop-2-enethioamide Openeye Name: 2-cyano-3-[1-methyl-5-(p-tolyl)pyrrol-2-yl]prop-2-enethioamide CAS Name: 2-cyano-3-[1-methyl-5-(4-methylphenyl)-2-pyrrolyl]-2-propenethioamide IUPAC Name: 2-cyano-3-[1-methyl-5-(4-methylphenyl)pyrrol-2-yl]prop-2-enethioamide Traditional Name: 2-cyano-3-[1-methyl-5-(p-tolyl)pyrrol-2-yl]thioacrylamide Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=C(N2C)C=C(C#N)C(=S)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=C(N2C)C=C(C#N)C(=S)N

InChI

InChI=1S/C16H15N3S/c1-11-3-5-12(6-4-11)15-8-7-14(19(15)2)9-13(10-17)16(18)20/h3-9H,1-2H3,(H2,18,20)