4-[4-[2-(cyclohexen-1-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-[4-[2-(cyclohexen-1-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperazine-1-carbaldehyde Openeye Name: 4-[4-[2-(cyclohexen-1-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carbaldehyde CAS Name: 4-[[4-[2-(1-cyclohexenyl)ethylamino]-5-methyl-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[4-[2-(cyclohexen-1-yl)ethylamino]-5-methylthieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carbaldehyde Traditional Name: 4-[4-[2-(cyclohexen-1-yl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]piperazine-1-carbaldehyde Formula: C21H27N5O2S MolecularWeight: 413.53638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCC3=CCCCC3)C(=O)N4CCN(CC4)C=O

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCC3=CCCCC3)C(=O)N4CCN(CC4)C=O

InChI

InChI=1S/C21H27N5O2S/c1-15-17-19(22-8-7-16-5-3-2-4-6-16)23-13-24-20(17)29-18(15)21(28)26-11-9-25(14-27)10-12-26/h5,13-14H,2-4,6-12H2,1H3,(H,22,23,24)