N-[4-(4-methylpiperidin-1-yl)phenyl]-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[4-(4-methylpiperidin-1-yl)phenyl]-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(4-methyl-1-piperidyl)phenyl]acetamide CAS Name: N-[4-(4-methyl-1-piperidinyl)phenyl]-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[4-(4-methylpiperidin-1-yl)phenyl]-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)thio]-N-[4-(4-methylpiperidino)phenyl]acetamide Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=NNC(=N3)C(C)C

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=NNC(=N3)C(C)C

InChI

InChI=1S/C19H27N5OS/c1-13(2)18-21-19(23-22-18)26-12-17(25)20-15-4-6-16(7-5-15)24-10-8-14(3)9-11-24/h4-7,13-14H,8-12H2,1-3H3,(H,20,25)(H,21,22,23)