4-[4-[2-(3-methoxyphenyl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperazin-2-one

Systemtic Name: 4-[4-[2-(3-methoxyphenyl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperazin-2-one Openeye Name: 4-[4-[2-(3-methoxyphenyl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]piperazin-2-one CAS Name: 4-[[4-[2-(3-methoxyphenyl)ethylamino]-5-methyl-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]-2-piperazinone IUPAC Name: 4-[4-[2-(3-methoxyphenyl)ethylamino]-5-methylthieno[2,3-d]pyrimidine-6-carbonyl]piperazin-2-one Traditional Name: 4-[4-[2-(3-methoxyphenyl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]piperazin-2-one Formula: C21H23N5O3S MolecularWeight: 425.50402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCC3=CC(=CC=C3)OC)C(=O)N4CCNC(=O)C4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCC3=CC(=CC=C3)OC)C(=O)N4CCNC(=O)C4

InChI

InChI=1S/C21H23N5O3S/c1-13-17-19(23-7-6-14-4-3-5-15(10-14)29-2)24-12-25-20(17)30-18(13)21(28)26-9-8-22-16(27)11-26/h3-5,10,12H,6-9,11H2,1-2H3,(H,22,27)(H,23,24,25)