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

Systemtic Name: ethyl 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-methyl-quinoline-3-carboxylate Openeye Name: ethyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-4-methyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-4-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C16H16N4O2S2 MolecularWeight: 360.45384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N4O2S2/c1-3-22-14(21)13-9(2)10-6-4-5-7-11(10)18-12(13)8-23-16-20-19-15(17)24-16/h4-7H,3,8H2,1-2H3,(H2,17,19)