(4Z)-4-[(5-chloranylbenzotriazol-1-yl)-sulfanyl-methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-4-[(5-chloranylbenzotriazol-1-yl)-sulfanyl-methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-4-[(5-chlorobenzotriazol-1-yl)-sulfanyl-methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: (4Z)-4-[(5-chloro-1-benzotriazolyl)-mercaptomethylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-4-[(5-chlorobenzotriazol-1-yl)-sulfanylmethylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: (4Z)-4-[(5-chlorobenzotriazol-1-yl)-mercapto-methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C13H8ClN3O2S MolecularWeight: 305.73952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=NN2C(=C3C=CC(=O)C=C3O)S

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=NN2/C(=C/3\C=CC(=O)C=C3O)/S

InChI

InChI=1S/C13H8ClN3O2S/c14-7-1-4-11-10(5-7)15-16-17(11)13(20)9-3-2-8(18)6-12(9)19/h1-6,19-20H/b13-9-