6-[2-(phenylsulfonyl)ethyl]-4-piperidin-1-yl-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

Systemtic Name: 6-[2-(phenylsulfonyl)ethyl]-4-piperidin-1-yl-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Openeye Name: 6-[2-(benzenesulfonyl)ethyl]-4-(1-piperidyl)-2-(3-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine CAS Name: 6-[2-(benzenesulfonyl)ethyl]-4-(1-piperidinyl)-2-(3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine IUPAC Name: 6-[2-(benzenesulfonyl)ethyl]-4-piperidin-1-yl-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Traditional Name: 6-(2-besylethyl)-4-piperidino-2-(3-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Formula: C25H29N5O2S MolecularWeight: 463.59506

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC3=C2CN(CC3)CCS(=O)(=O)C4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC3=C2CN(CC3)CCS(=O)(=O)C4=CC=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C25H29N5O2S/c31-33(32,21-9-3-1-4-10-21)17-16-29-15-11-23-22(19-29)25(30-13-5-2-6-14-30)28-24(27-23)20-8-7-12-26-18-20/h1,3-4,7-10,12,18H,2,5-6,11,13-17,19H2