ethyl 5-azanyl-7-methyl-2-methylsulfanyl-4-phenyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-azanyl-7-methyl-2-methylsulfanyl-4-phenyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-amino-7-methyl-2-methylsulfanyl-4-phenyl-pyrrolo[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-amino-7-methyl-2-(methylthio)-4-phenyl-6-pyrrolo[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-7-methyl-2-methylsulfanyl-4-phenylpyrrolo[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-amino-7-methyl-2-(methylthio)-4-phenyl-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H18N4O2S MolecularWeight: 342.41542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2N1C)SC)C3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2N1C)SC)C3=CC=CC=C3)N

InChI

InChI=1S/C17H18N4O2S/c1-4-23-16(22)14-12(18)11-13(10-8-6-5-7-9-10)19-17(24-3)20-15(11)21(14)2/h5-9H,4,18H2,1-3H3