ethyl 4-azanyl-6-methyl-2-(quinolin-2-ylsulfanylmethyl)furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-6-methyl-2-(quinolin-2-ylsulfanylmethyl)furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-6-methyl-2-(2-quinolylsulfanylmethyl)furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 4-amino-6-methyl-2-[(2-quinolinylthio)methyl]-5-furo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-6-methyl-2-(quinolin-2-ylsulfanylmethyl)furo[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-amino-6-methyl-2-[(2-quinolylthio)methyl]furo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester Formula: C20H18N4O3S MolecularWeight: 394.44692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)CSC3=NC4=CC=CC=C4C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=NC(=NC(=C12)N)CSC3=NC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C20H18N4O3S/c1-3-26-20(25)16-11(2)27-19-17(16)18(21)23-14(24-19)10-28-15-9-8-12-6-4-5-7-13(12)22-15/h4-9H,3,10H2,1-2H3,(H2,21,23,24)