[4-[(Z)-[5-azanylidene-2-(2-cyclohexylethyl)-7-oxidanylidene-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] furan-2-carboxylate

Systemtic Name: [4-[(Z)-[5-azanylidene-2-(2-cyclohexylethyl)-7-oxidanylidene-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] furan-2-carboxylate Openeye Name: [4-[(Z)-[2-(2-cyclohexylethyl)-5-imino-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[(Z)-[2-(2-cyclohexylethyl)-5-imino-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] ester IUPAC Name: [4-[(Z)-[2-(2-cyclohexylethyl)-5-imino-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[(Z)-[2-(2-cyclohexylethyl)-5-imino-7-keto-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] ester Formula: C25H24N4O4S MolecularWeight: 476.54746

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC2=NN3C(=N)C(=CC4=CC=C(C=C4)OC(=O)C5=CC=CO5)C(=O)N=C3S2

Isomeric SMILES

C1CCC(CC1)CCC2=NN3C(=N)/C(=C/C4=CC=C(C=C4)OC(=O)C5=CC=CO5)/C(=O)N=C3S2

InChI

InChI=1S/C25H24N4O4S/c26-22-19(15-17-8-11-18(12-9-17)33-24(31)20-7-4-14-32-20)23(30)27-25-29(22)28-21(34-25)13-10-16-5-2-1-3-6-16/h4,7-9,11-12,14-16,26H,1-3,5-6,10,13H2/b19-15-,26-22?