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

Systemtic Name: 5-methyl-4-[4-(phenylcarbonyl)piperazin-1-yl]carbonyl-2-pyrrol-1-yl-furan-3-carbonitrile Openeye Name: 4-(4-benzoylpiperazine-1-carbonyl)-5-methyl-2-pyrrol-1-yl-furan-3-carbonitrile CAS Name: 4-[(4-benzoyl-1-piperazinyl)-oxomethyl]-5-methyl-2-(1-pyrrolyl)-3-furancarbonitrile IUPAC Name: 4-(4-benzoylpiperazine-1-carbonyl)-5-methyl-2-pyrrol-1-ylfuran-3-carbonitrile Traditional Name: 4-(4-benzoylpiperazine-1-carbonyl)-5-methyl-2-pyrrol-1-yl-3-furonitrile Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O3/c1-16-19(18(15-23)22(29-16)26-9-5-6-10-26)21(28)25-13-11-24(12-14-25)20(27)17-7-3-2-4-8-17/h2-10H,11-14H2,1H3