N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CSCCNC(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

C1=COC(=C1)CSCCNC(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C16H16N4O2S/c21-16(18-7-9-23-10-15-2-1-8-22-15)13-3-5-14(6-4-13)20-12-17-11-19-20/h1-6,8,11-12H,7,9-10H2,(H,18,21)