2-[[5-chloranyl-2-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]aniline

Systemtic Name: 2-[[5-chloranyl-2-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]aniline Openeye Name: 2-[(2-benzyl-5-chloro-1,2,4-triazol-3-yl)sulfanyl]aniline CAS Name: 2-[[5-chloro-2-(phenylmethyl)-1,2,4-triazol-3-yl]thio]aniline IUPAC Name: 2-[(2-benzyl-5-chloro-1,2,4-triazol-3-yl)sulfanyl]aniline Traditional Name: [2-[(2-benzyl-5-chloro-1,2,4-triazol-3-yl)thio]phenyl]amine Formula: C15H13ClN4S MolecularWeight: 316.80852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NC(=N2)Cl)SC3=CC=CC=C3N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NC(=N2)Cl)SC3=CC=CC=C3N

InChI

InChI=1S/C15H13ClN4S/c16-14-18-15(21-13-9-5-4-8-12(13)17)20(19-14)10-11-6-2-1-3-7-11/h1-9H,10,17H2