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

Systemtic Name: 5-methyl-4-[methyl-(phenylmethyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 4-[benzyl(methyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[methyl-(phenylmethyl)amino]-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 4-[benzyl(methyl)amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[benzyl(methyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C16H14N3O2S- MolecularWeight: 312.36626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N(C)CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N(C)CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C16H15N3O2S/c1-10-12-14(19(2)8-11-6-4-3-5-7-11)17-9-18-15(12)22-13(10)16(20)21/h3-7,9H,8H2,1-2H3,(H,20,21)/p-1