1-(3,5-dimethylphenyl)carbonyl-N-methyl-4-(1H-pyrrol-2-ylcarbonylamino)piperidine-4-carboxamide

Systemtic Name: 1-(3,5-dimethylphenyl)carbonyl-N-methyl-4-(1H-pyrrol-2-ylcarbonylamino)piperidine-4-carboxamide Openeye Name: 1-(3,5-dimethylbenzoyl)-N-methyl-4-(1H-pyrrole-2-carbonylamino)piperidine-4-carboxamide CAS Name: 1-[(3,5-dimethylphenyl)-oxomethyl]-N-methyl-4-[[oxo(1H-pyrrol-2-yl)methyl]amino]-4-piperidinecarboxamide IUPAC Name: 1-(3,5-dimethylbenzoyl)-N-methyl-4-(1H-pyrrole-2-carbonylamino)piperidine-4-carboxamide Traditional Name: 1-(3,5-dimethylbenzoyl)-N-methyl-4-(1H-pyrrole-2-carbonylamino)isonipecotamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCC(CC2)(C(=O)NC)NC(=O)C3=CC=CN3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCC(CC2)(C(=O)NC)NC(=O)C3=CC=CN3)C

InChI

InChI=1S/C21H26N4O3/c1-14-11-15(2)13-16(12-14)19(27)25-9-6-21(7-10-25,20(28)22-3)24-18(26)17-5-4-8-23-17/h4-5,8,11-13,23H,6-7,9-10H2,1-3H3,(H,22,28)(H,24,26)