2-phenylsulfanyl-N-[2-[(1R)-1-pyridin-4-ylethyl]pyrazol-3-yl]pyridine-3-carboxamide

Systemtic Name: 2-phenylsulfanyl-N-[2-[(1R)-1-pyridin-4-ylethyl]pyrazol-3-yl]pyridine-3-carboxamide Openeye Name: 2-phenylsulfanyl-N-[2-[(1R)-1-(4-pyridyl)ethyl]pyrazol-3-yl]pyridine-3-carboxamide CAS Name: 2-(phenylthio)-N-[2-[(1R)-1-pyridin-4-ylethyl]-3-pyrazolyl]-3-pyridinecarboxamide IUPAC Name: 2-phenylsulfanyl-N-[2-[(1R)-1-pyridin-4-ylethyl]pyrazol-3-yl]pyridine-3-carboxamide Traditional Name: 2-(phenylthio)-N-[2-[(1R)-1-(4-pyridyl)ethyl]pyrazol-3-yl]nicotinamide Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)N2C(=CC=N2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C[C@H](C1=CC=NC=C1)N2C(=CC=N2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C22H19N5OS/c1-16(17-9-13-23-14-10-17)27-20(11-15-25-27)26-21(28)19-8-5-12-24-22(19)29-18-6-3-2-4-7-18/h2-16H,1H3,(H,26,28)/t16-/m1/s1