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

Systemtic Name: ethyl 4-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]quinoline-3-carboxylic acid ethyl ester Formula: C17H17N3O2S2 MolecularWeight: 359.46578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O2S2/c1-4-22-16(21)15-10(2)12-7-5-6-8-13(12)18-14(15)9-23-17-20-19-11(3)24-17/h5-8H,4,9H2,1-3H3