N-[(E)-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylideneamino]-2-oxidanylidene-2-piperidin-1-yl-ethanamide

Systemtic Name: N-[(E)-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylideneamino]-2-oxidanylidene-2-piperidin-1-yl-ethanamide Openeye Name: N-[(E)-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]methyleneamino]-2-oxo-2-(1-piperidyl)acetamide CAS Name: N-[(E)-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]methylideneamino]-2-oxo-2-(1-piperidinyl)acetamide IUPAC Name: N-[(E)-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylideneamino]-2-oxo-2-piperidin-1-ylacetamide Traditional Name: N-[(E)-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]methyleneamino]-2-keto-2-piperidino-acetamide Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C=NNC(=O)C(=O)N3CCCCC3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)/C=N/NC(=O)C(=O)N3CCCCC3)C

InChI

InChI=1S/C21H26N4O2/c1-15-7-9-19(10-8-15)25-16(2)13-18(17(25)3)14-22-23-20(26)21(27)24-11-5-4-6-12-24/h7-10,13-14H,4-6,11-12H2,1-3H3,(H,23,26)/b22-14+