2-(5-chloranyl-3,6-dimethyl-pyridin-2-yl)-7-methylidene-7-oxidanylidene-5,6,8,9-tetrahydro-[1,2,4]triazolo[1,2-d][1,4,5]thiadiazepine-1,3-dione

Systemtic Name: 2-(5-chloranyl-3,6-dimethyl-pyridin-2-yl)-7-methylidene-7-oxidanylidene-5,6,8,9-tetrahydro-[1,2,4]triazolo[1,2-d][1,4,5]thiadiazepine-1,3-dione Openeye Name: 2-(5-chloro-3,6-dimethyl-2-pyridyl)-7-methylene-7-oxo-5,6,8,9-tetrahydro-[1,2,4]triazolo[1,2-d][1,4,5]thiadiazepine-1,3-dione CAS Name: 2-(5-chloro-3,6-dimethyl-2-pyridinyl)-7-methylene-7-oxo-5,6,8,9-tetrahydro-[1,2,4]triazolo[1,2-d][1,4,5]thiadiazepine-1,3-dione IUPAC Name: 2-(5-chloro-3,6-dimethylpyridin-2-yl)-7-methylidene-7-oxo-5,6,8,9-tetrahydro-[1,2,4]triazolo[1,2-d][1,4,5]thiadiazepine-1,3-dione Traditional Name: 2-(5-chloro-3,6-dimethyl-2-pyridyl)-7-keto-7-methylene-5,6,8,9-tetrahydro-[1,2,4]triazolo[1,2-d][1,4,5]thiadiazepine-1,3-quinone Formula: C14H17ClN4O3S MolecularWeight: 356.82778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1N2C(=O)N3CCS(=C)(=O)CCN3C2=O)C)Cl

Isomeric SMILES

CC1=CC(=C(N=C1N2C(=O)N3CCS(=C)(=O)CCN3C2=O)C)Cl

InChI

InChI=1S/C14H17ClN4O3S/c1-9-8-11(15)10(2)16-12(9)19-13(20)17-4-6-23(3,22)7-5-18(17)14(19)21/h8H,3-7H2,1-2H3