2-[(4-phenoxy-2-piperidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)sulfonyl]benzenecarbonitrile

Systemtic Name: 2-[(4-phenoxy-2-piperidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)sulfonyl]benzenecarbonitrile Openeye Name: 2-[[4-phenoxy-2-(1-piperidyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]sulfonyl]benzonitrile CAS Name: 2-[[4-phenoxy-2-(1-piperidinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]sulfonyl]benzonitrile IUPAC Name: 2-[(4-phenoxy-2-piperidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)sulfonyl]benzonitrile Traditional Name: 2-[(4-phenoxy-2-piperidino-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)sulfonyl]benzonitrile Formula: C25H25N5O3S MolecularWeight: 475.5627

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC3=C(CN(CC3)S(=O)(=O)C4=CC=CC=C4C#N)C(=N2)OC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=NC3=C(CN(CC3)S(=O)(=O)C4=CC=CC=C4C#N)C(=N2)OC5=CC=CC=C5

InChI

InChI=1S/C25H25N5O3S/c26-17-19-9-5-6-12-23(19)34(31,32)30-16-13-22-21(18-30)24(33-20-10-3-1-4-11-20)28-25(27-22)29-14-7-2-8-15-29/h1,3-6,9-12H,2,7-8,13-16,18H2