4-(5-butan-2-yl-3H-1,3,4-thiadiazol-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(5-butan-2-yl-3H-1,3,4-thiadiazol-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(5-sec-butyl-3H-1,3,4-thiadiazol-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(5-butan-2-yl-3H-1,3,4-thiadiazol-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(5-butan-2-yl-3H-1,3,4-thiadiazol-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(5-sec-butyl-3H-1,3,4-thiadiazol-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C12H14N2OS MolecularWeight: 234.31736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=NNC(=C2C=CC(=O)C=C2)S1

Isomeric SMILES

CCC(C)C1=NNC(=C2C=CC(=O)C=C2)S1

InChI

InChI=1S/C12H14N2OS/c1-3-8(2)11-13-14-12(16-11)9-4-6-10(15)7-5-9/h4-8,14H,3H2,1-2H3