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

Systemtic Name: methyl 4-methyl-2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]quinoline-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C16H16N4O2S2 MolecularWeight: 360.45384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(S3)NC)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(S3)NC)C(=O)OC

InChI

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