1-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-7,7-dimethyl-4-thiophen-3-yl-3,4,6,8-tetrahydroquinoline-2,5-dione

Systemtic Name: 1-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-7,7-dimethyl-4-thiophen-3-yl-3,4,6,8-tetrahydroquinoline-2,5-dione Openeye Name: 1-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-7,7-dimethyl-4-(3-thienyl)-3,4,6,8-tetrahydroquinoline-2,5-dione CAS Name: 1-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-7,7-dimethyl-4-(3-thiophenyl)-3,4,6,8-tetrahydroquinoline-2,5-dione IUPAC Name: 1-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-7,7-dimethyl-4-thiophen-3-yl-3,4,6,8-tetrahydroquinoline-2,5-dione Traditional Name: 1-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-7,7-dimethyl-4-(3-thienyl)-3,4,6,8-tetrahydroquinoline-2,5-quinone Formula: C19H21N3O2S3 MolecularWeight: 419.58394

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)N2C(=O)CC(C3=C2CC(CC3=O)(C)C)C4=CSC=C4

Isomeric SMILES

CCSC1=NN=C(S1)N2C(=O)CC(C3=C2CC(CC3=O)(C)C)C4=CSC=C4

InChI

InChI=1S/C19H21N3O2S3/c1-4-26-18-21-20-17(27-18)22-13-8-19(2,3)9-14(23)16(13)12(7-15(22)24)11-5-6-25-10-11/h5-6,10,12H,4,7-9H2,1-3H3