N-(3-phenylpropyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-phenylpropyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(3-phenylpropyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(3-phenylpropyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-phenylpropyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-phenylpropyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)CSC2=NNC(=N2)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)CSC2=NNC(=N2)C3=CC=CS3

InChI

InChI=1S/C17H18N4OS2/c22-15(18-10-4-8-13-6-2-1-3-7-13)12-24-17-19-16(20-21-17)14-9-5-11-23-14/h1-3,5-7,9,11H,4,8,10,12H2,(H,18,22)(H,19,20,21)