N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-cyano-N,2-dimethyl-5-pyrrol-1-yl-furan-3-carboxamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-cyano-N,2-dimethyl-5-pyrrol-1-yl-furan-3-carboxamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-4-cyano-N,2-dimethyl-5-pyrrol-1-yl-furan-3-carboxamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-cyano-N,2-dimethyl-5-(1-pyrrolyl)-3-furancarboxamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-4-cyano-N,2-dimethyl-5-pyrrol-1-ylfuran-3-carboxamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-4-cyano-N,2-dimethyl-5-pyrrol-1-yl-3-furamide Formula: C21H19BrN4O3 MolecularWeight: 455.30456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)C2=C(OC(=C2C#N)N3C=CC=C3)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)C2=C(OC(=C2C#N)N3C=CC=C3)C

InChI

InChI=1S/C21H19BrN4O3/c1-13-10-15(22)6-7-17(13)24-18(27)12-25(3)20(28)19-14(2)29-21(16(19)11-23)26-8-4-5-9-26/h4-10H,12H2,1-3H3,(H,24,27)