N-(6-chloranyl-1,3-benzothiazol-2-yl)-5-(4-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-5-(4-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-5-(4-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-5-(4-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-1,2-dihydropyrazole-3-carboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-5-(4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-5-(6-keto-4-methyl-cyclohexa-2,4-dien-1-ylidene)-3-pyrazoline-3-carboxamide Formula: C18H13ClN4O2S MolecularWeight: 384.83942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C2C=C(NN2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl)C=C1

Isomeric SMILES

CC1=CC(=O)C(=C2C=C(NN2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl)C=C1

InChI

InChI=1S/C18H13ClN4O2S/c1-9-2-4-11(15(24)6-9)13-8-14(23-22-13)17(25)21-18-20-12-5-3-10(19)7-16(12)26-18/h2-8,22-23H,1H3,(H,20,21,25)