N-(4-methylhexyl)-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2H-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-(4-methylhexyl)-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2H-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-(4-methylhexyl)-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-2H-thiadiazole-4-carboxamide CAS Name: N-(4-methylhexyl)-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-2H-thiadiazole-4-carboxamide IUPAC Name: N-(4-methylhexyl)-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-2H-thiadiazole-4-carboxamide Traditional Name: 5-(4-ketocyclohexa-2,5-dien-1-ylidene)-N-(4-methylhexyl)-2H-thiadiazole-4-carboxamide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCNC(=O)C1=NNSC1=C2C=CC(=O)C=C2

Isomeric SMILES

CCC(C)CCCNC(=O)C1=NNSC1=C2C=CC(=O)C=C2

InChI

InChI=1S/C16H21N3O2S/c1-3-11(2)5-4-10-17-16(21)14-15(22-19-18-14)12-6-8-13(20)9-7-12/h6-9,11,19H,3-5,10H2,1-2H3,(H,17,21)