N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[2-(2-thienylmethylsulfanyl)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[2-(thiophen-2-ylmethylthio)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[2-(2-thenylthio)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CSCCNC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

C1=CSC(=C1)CSCCNC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

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