N-cyclopropyl-N-[1-(phenylmethyl)-4-(prop-2-enylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-cyclopropyl-N-[1-(phenylmethyl)-4-(prop-2-enylcarbamoyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-[4-(allylcarbamoyl)-1-benzyl-4-piperidyl]-N-cyclopropyl-pyridine-3-carboxamide CAS Name: N-cyclopropyl-N-[4-[oxo-(prop-2-enylamino)methyl]-1-(phenylmethyl)-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-[1-benzyl-4-(prop-2-enylcarbamoyl)piperidin-4-yl]-N-cyclopropylpyridine-3-carboxamide Traditional Name: N-[4-(allylcarbamoyl)-1-benzyl-4-piperidyl]-N-cyclopropyl-nicotinamide Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1(CCN(CC1)CC2=CC=CC=C2)N(C3CC3)C(=O)C4=CN=CC=C4

Isomeric SMILES

C=CCNC(=O)C1(CCN(CC1)CC2=CC=CC=C2)N(C3CC3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C25H30N4O2/c1-2-14-27-24(31)25(12-16-28(17-13-25)19-20-7-4-3-5-8-20)29(22-10-11-22)23(30)21-9-6-15-26-18-21/h2-9,15,18,22H,1,10-14,16-17,19H2,(H,27,31)