ethyl 4-methyl-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]quinoline-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]quinoline-3-carboxylic acid ethyl ester Formula: C17H18N4O2S2 MolecularWeight: 374.48042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CSC3=NN=C(S3)NC)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CSC3=NN=C(S3)NC)C

InChI

InChI=1S/C17H18N4O2S2/c1-4-23-15(22)14-10(2)11-7-5-6-8-12(11)19-13(14)9-24-17-21-20-16(18-3)25-17/h5-8H,4,9H2,1-3H3,(H,18,20)