ethyl 4-methyl-2-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]quinoline-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-[[2-(morpholinomethyl)quinazolin-4-yl]sulfanylmethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[[2-(morpholinomethyl)quinazolin-4-yl]thio]methyl]quinoline-3-carboxylic acid ethyl ester Formula: C27H28N4O3S MolecularWeight: 488.60122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CSC3=NC(=NC4=CC=CC=C43)CN5CCOCC5)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CSC3=NC(=NC4=CC=CC=C43)CN5CCOCC5)C

InChI

InChI=1S/C27H28N4O3S/c1-3-34-27(32)25-18(2)19-8-4-6-10-21(19)28-23(25)17-35-26-20-9-5-7-11-22(20)29-24(30-26)16-31-12-14-33-15-13-31/h4-11H,3,12-17H2,1-2H3