4-(1,3-benzothiazol-2-ylsulfanyl)-5-methyl-3-oxidanylidene-1H-pyrazole-2-carboxamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-5-methyl-3-oxidanylidene-1H-pyrazole-2-carboxamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-5-methyl-3-oxo-1H-pyrazole-2-carboxamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-5-methyl-3-oxo-1H-pyrazole-2-carboxamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-5-methyl-3-oxo-1H-pyrazole-2-carboxamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-5-keto-3-methyl-3-pyrazoline-1-carboxamide Formula: C12H10N4O2S2 MolecularWeight: 306.3634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C(=O)N)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C(=O)N(N1)C(=O)N)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C12H10N4O2S2/c1-6-9(10(17)16(15-6)11(13)18)20-12-14-7-4-2-3-5-8(7)19-12/h2-5,15H,1H3,(H2,13,18)