(2-sulfanylidene-1,3-benzothiazol-3-yl)methyl 2-methylquinoline-4-carboxylate

Systemtic Name: (2-sulfanylidene-1,3-benzothiazol-3-yl)methyl 2-methylquinoline-4-carboxylate Openeye Name: (2-thioxo-1,3-benzothiazol-3-yl)methyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid (2-sulfanylidene-1,3-benzothiazol-3-yl)methyl ester IUPAC Name: (2-sulfanylidene-1,3-benzothiazol-3-yl)methyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid (2-thioxo-1,3-benzothiazol-3-yl)methyl ester Formula: C19H14N2O2S2 MolecularWeight: 366.45666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCN3C4=CC=CC=C4SC3=S

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCN3C4=CC=CC=C4SC3=S

InChI

InChI=1S/C19H14N2O2S2/c1-12-10-14(13-6-2-3-7-15(13)20-12)18(22)23-11-21-16-8-4-5-9-17(16)25-19(21)24/h2-10H,11H2,1H3