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

Systemtic Name: 2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]butanamide CAS Name: 2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]butanamide Traditional Name: N-benzyl-2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]butyramide Formula: C18H20N4OS2 MolecularWeight: 372.5076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN=C(N2C)C3=CC=CS3

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN=C(N2C)C3=CC=CS3

InChI

InChI=1S/C18H20N4OS2/c1-3-14(17(23)19-12-13-8-5-4-6-9-13)25-18-21-20-16(22(18)2)15-10-7-11-24-15/h4-11,14H,3,12H2,1-2H3,(H,19,23)