ethyl 4-[4-[(3-methoxyphenyl)methylamino]-5-methyl-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(3-methoxyphenyl)methylamino]-5-methyl-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[(3-methoxyphenyl)methylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(3-methoxyphenyl)methylamino]-5-methyl-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-methoxyphenyl)methylamino]-5-methylthieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[4-(m-anisylamino)-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H27N5O4S MolecularWeight: 469.55658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C3=C(N=CN=C3S2)NCC4=CC(=CC=C4)OC)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C3=C(N=CN=C3S2)NCC4=CC(=CC=C4)OC)C

InChI

InChI=1S/C23H27N5O4S/c1-4-32-23(30)28-10-8-27(9-11-28)22(29)19-15(2)18-20(25-14-26-21(18)33-19)24-13-16-6-5-7-17(12-16)31-3/h5-7,12,14H,4,8-11,13H2,1-3H3,(H,24,25,26)