ethyl 4-methyl-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)quinoline-3-carboxylate CAS Name: 4-methyl-2-[(4-thieno[2,3-d]pyrimidinylthio)methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)quinoline-3-carboxylate Traditional Name: 4-methyl-2-[(thieno[2,3-d]pyrimidin-4-ylthio)methyl]quinoline-3-carboxylic acid ethyl ester Formula: C20H17N3O2S2 MolecularWeight: 395.49788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CSC3=NC=NC4=C3C=CS4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CSC3=NC=NC4=C3C=CS4)C

InChI

InChI=1S/C20H17N3O2S2/c1-3-25-20(24)17-12(2)13-6-4-5-7-15(13)23-16(17)10-27-19-14-8-9-26-18(14)21-11-22-19/h4-9,11H,3,10H2,1-2H3