4-[(4-hydroxyphenyl)-methyl-amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 4-[(4-hydroxyphenyl)-methyl-amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 4-(4-hydroxy-N-methyl-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(4-hydroxy-N-methylanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 4-(4-hydroxy-N-methylanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(4-hydroxy-N-methyl-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C15H12N3O3S- MolecularWeight: 314.33908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N(C)C3=CC=C(C=C3)O)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N(C)C3=CC=C(C=C3)O)C(=O)[O-]

InChI

InChI=1S/C15H13N3O3S/c1-8-11-13(18(2)9-3-5-10(19)6-4-9)16-7-17-14(11)22-12(8)15(20)21/h3-7,19H,1-2H3,(H,20,21)/p-1