N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-(3-prop-2-enoxypropanoyl)piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-(3-prop-2-enoxypropanoyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: 2-[1-(3-allyloxypropanoyl)-4-piperidyl]-N-(4-imidazol-1-ylphenyl)-6-methyl-pyridine-3-carboxamide CAS Name: N-[4-(1-imidazolyl)phenyl]-6-methyl-2-[1-(1-oxo-3-prop-2-enoxypropyl)-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-(3-prop-2-enoxypropanoyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: 2-[1-(3-allyloxypropanoyl)-4-piperidyl]-N-(4-imidazol-1-ylphenyl)-6-methyl-nicotinamide Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4CCN(CC4)C(=O)CCOCC=C

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4CCN(CC4)C(=O)CCOCC=C

InChI

InChI=1S/C27H31N5O3/c1-3-17-35-18-12-25(33)31-14-10-21(11-15-31)26-24(9-4-20(2)29-26)27(34)30-22-5-7-23(8-6-22)32-16-13-28-19-32/h3-9,13,16,19,21H,1,10-12,14-15,17-18H2,2H3,(H,30,34)