N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-N-[[4-(1-piperidyl)phenyl]methyl]acetamide CAS Name: N-methyl-N-[[4-(1-piperidinyl)phenyl]methyl]-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-methyl-N-[(4-piperidin-1-ylphenyl)methyl]-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-isopropyl-1,2,4-triazol-3-yl)thio]-N-methyl-N-(4-piperidinobenzyl)acetamide Formula: C20H29N5OS MolecularWeight: 387.54216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCC(=O)N(C)CC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CC(C)N1C=NN=C1SCC(=O)N(C)CC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C20H29N5OS/c1-16(2)25-15-21-22-20(25)27-14-19(26)23(3)13-17-7-9-18(10-8-17)24-11-5-4-6-12-24/h7-10,15-16H,4-6,11-14H2,1-3H3