N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-[(E)-2-cyanoethenyl]phenyl]-1-propan-2-yl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-[(E)-2-cyanoethenyl]phenyl]-1-propan-2-yl-piperidine-4-carboxamide Openeye Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]-4-[(E)-2-cyanovinyl]phenyl]-1-isopropyl-piperidine-4-carboxamide CAS Name: N-[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-4-[(E)-2-cyanoethenyl]phenyl]-1-propan-2-yl-4-piperidinecarboxamide IUPAC Name: N-[2-[(5-chloropyridin-2-yl)carbamoyl]-4-[(E)-2-cyanoethenyl]phenyl]-1-propan-2-ylpiperidine-4-carboxamide Traditional Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]-4-[(E)-2-cyanovinyl]phenyl]-1-isopropyl-isonipecotamide Formula: C24H26ClN5O2 MolecularWeight: 451.94854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)C=CC#N)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)/C=C/C#N)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C24H26ClN5O2/c1-16(2)30-12-9-18(10-13-30)23(31)28-21-7-5-17(4-3-11-26)14-20(21)24(32)29-22-8-6-19(25)15-27-22/h3-8,14-16,18H,9-10,12-13H2,1-2H3,(H,28,31)(H,27,29,32)/b4-3+