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

Systemtic Name: 5-methyl-4-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]carbonyl-2-pyrrol-1-yl-furan-3-carbonitrile Openeye Name: 5-methyl-4-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazine-1-carbonyl]-2-pyrrol-1-yl-furan-3-carbonitrile CAS Name: 5-methyl-4-[oxo-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazinyl]methyl]-2-(1-pyrrolyl)-3-furancarbonitrile IUPAC Name: 5-methyl-4-[4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carbonyl]-2-pyrrol-1-ylfuran-3-carbonitrile Traditional Name: 4-[4-(2-keto-2-piperidino-ethyl)piperazine-1-carbonyl]-5-methyl-2-pyrrol-1-yl-3-furonitrile Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCN(CC3)CC(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCN(CC3)CC(=O)N4CCCCC4

InChI

InChI=1S/C22H27N5O3/c1-17-20(18(15-23)22(30-17)27-9-5-6-10-27)21(29)26-13-11-24(12-14-26)16-19(28)25-7-3-2-4-8-25/h5-6,9-10H,2-4,7-8,11-14,16H2,1H3