2-phenylsulfanyl-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide

Systemtic Name: 2-phenylsulfanyl-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide Openeye Name: 2-phenylsulfanyl-N-[4-(1-piperidylmethyl)thiazol-2-yl]pyridine-3-carboxamide CAS Name: 2-(phenylthio)-N-[4-(1-piperidinylmethyl)-2-thiazolyl]-3-pyridinecarboxamide IUPAC Name: 2-phenylsulfanyl-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide Traditional Name: 2-(phenylthio)-N-[4-(piperidinomethyl)thiazol-2-yl]nicotinamide Formula: C21H22N4OS2 MolecularWeight: 410.55558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CSC(=N2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC2=CSC(=N2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C21H22N4OS2/c26-19(18-10-7-11-22-20(18)28-17-8-3-1-4-9-17)24-21-23-16(15-27-21)14-25-12-5-2-6-13-25/h1,3-4,7-11,15H,2,5-6,12-14H2,(H,23,24,26)