4-(azepan-1-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 4-(azepan-1-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 4-(azepan-1-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(1-azepanyl)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 4-(azepan-1-yl)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(azepan-1-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C14H16N3O2S- MolecularWeight: 290.36074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCCCCC3)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCCCCC3)C(=O)[O-]

InChI

InChI=1S/C14H17N3O2S/c1-9-10-12(17-6-4-2-3-5-7-17)15-8-16-13(10)20-11(9)14(18)19/h8H,2-7H2,1H3,(H,18,19)/p-1