N-methyl-N-(phenylmethyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-methyl-N-(phenylmethyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-benzyl-N-methyl-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-methyl-N-(phenylmethyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-benzyl-N-methyl-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-benzyl-N-methyl-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC=CC=C1)SC2=NNC(=N2)C3=CC=CS3

Isomeric SMILES

CC(C(=O)N(C)CC1=CC=CC=C1)SC2=NNC(=N2)C3=CC=CS3

InChI

InChI=1S/C17H18N4OS2/c1-12(16(22)21(2)11-13-7-4-3-5-8-13)24-17-18-15(19-20-17)14-9-6-10-23-14/h3-10,12H,11H2,1-2H3,(H,18,19,20)