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

Systemtic Name: 2-azanyl-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-5-oxidanylidene-1-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-(2,5-dimethyl-3-thienyl)-7,7-dimethyl-5-oxo-1-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-(2,5-dimethyl-3-thiophenyl)-7,7-dimethyl-5-oxo-1-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-5-oxo-1-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-(2,5-dimethyl-3-thienyl)-5-keto-7,7-dimethyl-1-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C20H21N5OS3 MolecularWeight: 443.60864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=NNC(=S)S4)N)C#N

Isomeric SMILES

CC1=CC(=C(S1)C)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=NNC(=S)S4)N)C#N

InChI

InChI=1S/C20H21N5OS3/c1-9-5-11(10(2)28-9)15-12(8-21)17(22)25(18-23-24-19(27)29-18)13-6-20(3,4)7-14(26)16(13)15/h5,15H,6-7,22H2,1-4H3,(H,24,27)