1-[5-methyl-2-(6-methyl-1,3-benzothiazol-2-yl)-3-oxidanylidene-1H-pyrazol-4-yl]butane-1,3-dione

Systemtic Name: 1-[5-methyl-2-(6-methyl-1,3-benzothiazol-2-yl)-3-oxidanylidene-1H-pyrazol-4-yl]butane-1,3-dione Openeye Name: 1-[5-methyl-2-(6-methyl-1,3-benzothiazol-2-yl)-3-oxo-1H-pyrazol-4-yl]butane-1,3-dione CAS Name: 1-[5-methyl-2-(6-methyl-1,3-benzothiazol-2-yl)-3-oxo-1H-pyrazol-4-yl]butane-1,3-dione IUPAC Name: 1-[5-methyl-2-(6-methyl-1,3-benzothiazol-2-yl)-3-oxo-1H-pyrazol-4-yl]butane-1,3-dione Traditional Name: 1-[5-keto-3-methyl-1-(6-methyl-1,3-benzothiazol-2-yl)-3-pyrazolin-4-yl]butane-1,3-dione Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N3C(=O)C(=C(N3)C)C(=O)CC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N3C(=O)C(=C(N3)C)C(=O)CC(=O)C

InChI

InChI=1S/C16H15N3O3S/c1-8-4-5-11-13(6-8)23-16(17-11)19-15(22)14(10(3)18-19)12(21)7-9(2)20/h4-6,18H,7H2,1-3H3