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

Systemtic Name: 2-azanyl-7,7-dimethyl-4-(5-methylfuran-2-yl)-5-oxidanylidene-1-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-7,7-dimethyl-4-(5-methyl-2-furyl)-5-oxo-1-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-7,7-dimethyl-4-(5-methyl-2-furanyl)-5-oxo-1-[5-(propylthio)-1,3,4-thiadiazol-2-yl]-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-7,7-dimethyl-4-(5-methylfuran-2-yl)-5-oxo-1-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-5-keto-7,7-dimethyl-4-(5-methyl-2-furyl)-1-[5-(propylthio)-1,3,4-thiadiazol-2-yl]-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C22H25N5O2S2 MolecularWeight: 455.5962

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)N2C3=C(C(C(=C2N)C#N)C4=CC=C(O4)C)C(=O)CC(C3)(C)C

Isomeric SMILES

CCCSC1=NN=C(S1)N2C3=C(C(C(=C2N)C#N)C4=CC=C(O4)C)C(=O)CC(C3)(C)C

InChI

InChI=1S/C22H25N5O2S2/c1-5-8-30-21-26-25-20(31-21)27-14-9-22(3,4)10-15(28)18(14)17(13(11-23)19(27)24)16-7-6-12(2)29-16/h6-7,17H,5,8-10,24H2,1-4H3