cyclohexyl 2-[[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]sulfanyl]ethanoate

Systemtic Name: cyclohexyl 2-[[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]sulfanyl]ethanoate Openeye Name: cyclohexyl 2-[[2-(6-oxocyclohexa-2,4-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]sulfanyl]acetate CAS Name: 2-[[2-(6-oxo-1-cyclohexa-2,4-dienylidene)-3H-1,3,4-oxadiazol-5-yl]thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[[2-(6-oxocyclohexa-2,4-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]sulfanyl]acetate Traditional Name: 2-[[2-(6-ketocyclohexa-2,4-dien-1-ylidene)-3H-1,3,4-oxadiazol-5-yl]thio]acetic acid cyclohexyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)CSC2=NNC(=C3C=CC=CC3=O)O2

Isomeric SMILES

C1CCC(CC1)OC(=O)CSC2=NNC(=C3C=CC=CC3=O)O2

InChI

InChI=1S/C16H18N2O4S/c19-13-9-5-4-8-12(13)15-17-18-16(22-15)23-10-14(20)21-11-6-2-1-3-7-11/h4-5,8-9,11,17H,1-3,6-7,10H2