5-methyl-4-[2-(naphthalen-1-ylamino)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 5-methyl-4-[2-(naphthalen-1-ylamino)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-4-[2-(1-naphthylamino)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[2-(1-naphthalenylamino)ethylamino]-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 5-methyl-4-[2-(naphthalen-1-ylamino)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-[2-(1-naphthylamino)ethylamino]thieno[2,3-d]pyrimidine-6-carboxylate Formula: C20H17N4O2S- MolecularWeight: 377.43958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCNC3=CC=CC4=CC=CC=C43)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCNC3=CC=CC4=CC=CC=C43)C(=O)[O-]

InChI

InChI=1S/C20H18N4O2S/c1-12-16-18(23-11-24-19(16)27-17(12)20(25)26)22-10-9-21-15-8-4-6-13-5-2-3-7-14(13)15/h2-8,11,21H,9-10H2,1H3,(H,25,26)(H,22,23,24)/p-1