methyl 2-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methyl-thieno[2,3-d]pyrimidin-6-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methyl-thieno[2,3-d]pyrimidin-6-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]amino]benzoate CAS Name: 2-[[[4-[4-(2-methoxyphenyl)-1-piperazinyl]-5-methyl-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]-5-methylthieno[2,3-d]pyrimidine-6-carbonyl]amino]benzoate Traditional Name: 2-[[4-[4-(2-methoxyphenyl)piperazino]-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]amino]benzoic acid methyl ester Formula: C27H27N5O4S MolecularWeight: 517.59938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=C4OC)C(=O)NC5=CC=CC=C5C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=C4OC)C(=O)NC5=CC=CC=C5C(=O)OC

InChI

InChI=1S/C27H27N5O4S/c1-17-22-24(32-14-12-31(13-15-32)20-10-6-7-11-21(20)35-2)28-16-29-26(22)37-23(17)25(33)30-19-9-5-4-8-18(19)27(34)36-3/h4-11,16H,12-15H2,1-3H3,(H,30,33)