N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-[2-(pent-3-enoylamino)ethanoyl]piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-[2-(pent-3-enoylamino)ethanoyl]piperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-[2-(pent-3-enoylamino)acetyl]-4-piperidyl]pyridine-3-carboxamide CAS Name: N-[4-(1-imidazolyl)phenyl]-6-methyl-2-[1-[1-oxo-2-(1-oxopent-3-enylamino)ethyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-[2-(pent-3-enoylamino)acetyl]piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-[2-(pent-3-enoylamino)acetyl]-4-piperidyl]nicotinamide Formula: C28H32N6O3 MolecularWeight: 500.59208

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC(=O)NCC(=O)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)NC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

CC=CCC(=O)NCC(=O)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)NC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C28H32N6O3/c1-3-4-5-25(35)30-18-26(36)33-15-12-21(13-16-33)27-24(11-6-20(2)31-27)28(37)32-22-7-9-23(10-8-22)34-17-14-29-19-34/h3-4,6-11,14,17,19,21H,5,12-13,15-16,18H2,1-2H3,(H,30,35)(H,32,37)