butyl 5-azanyl-2-methylsulfanyl-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: butyl 5-azanyl-2-methylsulfanyl-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: butyl 5-amino-2-methylsulfanyl-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-amino-2-(methylthio)-4-phenyl-6-thieno[2,3-d]pyrimidinecarboxylic acid butyl ester IUPAC Name: butyl 5-amino-2-methylsulfanyl-4-phenylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-amino-2-(methylthio)-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylic acid butyl ester Formula: C18H19N3O2S2 MolecularWeight: 373.49236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C2=C(N=C(N=C2S1)SC)C3=CC=CC=C3)N

Isomeric SMILES

CCCCOC(=O)C1=C(C2=C(N=C(N=C2S1)SC)C3=CC=CC=C3)N

InChI

InChI=1S/C18H19N3O2S2/c1-3-4-10-23-17(22)15-13(19)12-14(11-8-6-5-7-9-11)20-18(24-2)21-16(12)25-15/h5-9H,3-4,10,19H2,1-2H3