2-chloranyl-N-(2-phenylsulfanylethyl)-4-(1,2,4-triazol-4-yl)benzamide

Systemtic Name: 2-chloranyl-N-(2-phenylsulfanylethyl)-4-(1,2,4-triazol-4-yl)benzamide Openeye Name: 2-chloro-N-(2-phenylsulfanylethyl)-4-(1,2,4-triazol-4-yl)benzamide CAS Name: 2-chloro-N-[2-(phenylthio)ethyl]-4-(1,2,4-triazol-4-yl)benzamide IUPAC Name: 2-chloro-N-(2-phenylsulfanylethyl)-4-(1,2,4-triazol-4-yl)benzamide Traditional Name: 2-chloro-N-[2-(phenylthio)ethyl]-4-(1,2,4-triazol-4-yl)benzamide Formula: C17H15ClN4OS MolecularWeight: 358.8452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)C2=C(C=C(C=C2)N3C=NN=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)C2=C(C=C(C=C2)N3C=NN=C3)Cl

InChI

InChI=1S/C17H15ClN4OS/c18-16-10-13(22-11-20-21-12-22)6-7-15(16)17(23)19-8-9-24-14-4-2-1-3-5-14/h1-7,10-12H,8-9H2,(H,19,23)