5-methyl-4-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-2-pyrrol-1-yl-furan-3-carbonitrile

Systemtic Name: 5-methyl-4-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-2-pyrrol-1-yl-furan-3-carbonitrile Openeye Name: 5-methyl-4-[4-(4-nitrophenyl)sulfonylpiperazine-1-carbonyl]-2-pyrrol-1-yl-furan-3-carbonitrile CAS Name: 5-methyl-4-[[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-(1-pyrrolyl)-3-furancarbonitrile IUPAC Name: 5-methyl-4-[4-(4-nitrophenyl)sulfonylpiperazine-1-carbonyl]-2-pyrrol-1-ylfuran-3-carbonitrile Traditional Name: 5-methyl-4-(4-nosylpiperazine-1-carbonyl)-2-pyrrol-1-yl-3-furonitrile Formula: C21H19N5O6S MolecularWeight: 469.47046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N5O6S/c1-15-19(18(14-22)21(32-15)24-8-2-3-9-24)20(27)23-10-12-25(13-11-23)33(30,31)17-6-4-16(5-7-17)26(28)29/h2-9H,10-13H2,1H3