3-[(2-azanyl-6-chloranyl-phenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(2-azanyl-6-chloranyl-phenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(2-amino-6-chloro-phenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(2-amino-6-chlorophenyl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(2-amino-6-chlorophenyl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(2-amino-6-chloro-phenyl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C14H11ClN4OS MolecularWeight: 318.78134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=C(C=CC=C3Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=C(C=CC=C3Cl)N

InChI

InChI=1S/C14H11ClN4OS/c15-10-5-3-6-11(16)13(10)21-8-19-14(20)9-4-1-2-7-12(9)17-18-19/h1-7H,8,16H2