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

Systemtic Name: 4-[(4-dimethylaminophenyl)amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 4-[4-(dimethylamino)anilino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[4-(dimethylamino)anilino]-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 4-[4-(dimethylamino)anilino]-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[4-(dimethylamino)anilino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C17H17N4O2S- MolecularWeight: 341.40748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NC3=CC=C(C=C3)N(C)C)C)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NC3=CC=C(C=C3)N(C)C)C)C(=O)[O-]

InChI

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