N-methyl-N-[(3-methylthiophen-2-yl)methyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-methyl-N-[(3-methylthiophen-2-yl)methyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-methyl-N-[(3-methyl-2-thienyl)methyl]-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-methyl-N-[(3-methyl-2-thiophenyl)methyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-methyl-N-[(3-methylthiophen-2-yl)methyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-methyl-N-[(3-methyl-2-thienyl)methyl]-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H17N5OS2 MolecularWeight: 359.46908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C)C(=O)CSC2=NNC(=N2)C3=CC=NC=C3

Isomeric SMILES

CC1=C(SC=C1)CN(C)C(=O)CSC2=NNC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C16H17N5OS2/c1-11-5-8-23-13(11)9-21(2)14(22)10-24-16-18-15(19-20-16)12-3-6-17-7-4-12/h3-8H,9-10H2,1-2H3,(H,18,19,20)