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

Systemtic Name: thiophen-2-ylmethyl 5-azanyl-2-methylsulfanyl-4-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-thienylmethyl 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 thiophen-2-ylmethyl ester IUPAC Name: thiophen-2-ylmethyl 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 2-thenyl ester Formula: C19H15N3O2S3 MolecularWeight: 413.5363

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C2C(=C(SC2=N1)C(=O)OCC3=CC=CS3)N)C4=CC=CC=C4

Isomeric SMILES

CSC1=NC(=C2C(=C(SC2=N1)C(=O)OCC3=CC=CS3)N)C4=CC=CC=C4

InChI

InChI=1S/C19H15N3O2S3/c1-25-19-21-15(11-6-3-2-4-7-11)13-14(20)16(27-17(13)22-19)18(23)24-10-12-8-5-9-26-12/h2-9H,10,20H2,1H3