2-azanyl-4-(furan-2-yl)-7,7-dimethyl-5-oxidanylidene-1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(furan-2-yl)-7,7-dimethyl-5-oxidanylidene-1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-(2-furyl)-7,7-dimethyl-5-oxo-1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-(2-furanyl)-7,7-dimethyl-5-oxo-1-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-(furan-2-yl)-7,7-dimethyl-5-oxo-1-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-(2-furyl)-5-keto-7,7-dimethyl-1-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C26H23N5O3S2 MolecularWeight: 517.62252

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)C4=CC=CC=C4)N)C#N)C5=CC=CO5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(N2C3=NN=C(S3)SCC(=O)C4=CC=CC=C4)N)C#N)C5=CC=CO5)C(=O)C1)C

InChI

InChI=1S/C26H23N5O3S2/c1-26(2)11-17-22(18(32)12-26)21(20-9-6-10-34-20)16(13-27)23(28)31(17)24-29-30-25(36-24)35-14-19(33)15-7-4-3-5-8-15/h3-10,21H,11-12,14,28H2,1-2H3