2-[4-(1,2-dihydroacenaphthylen-3-ylsulfonyl)piperazin-1-yl]-4-methyl-6-piperidin-1-yl-pyrimidine

Systemtic Name: 2-[4-(1,2-dihydroacenaphthylen-3-ylsulfonyl)piperazin-1-yl]-4-methyl-6-piperidin-1-yl-pyrimidine Openeye Name: 2-[4-(1,2-dihydroacenaphthylen-3-ylsulfonyl)piperazin-1-yl]-4-methyl-6-(1-piperidyl)pyrimidine CAS Name: 2-[4-(1,2-dihydroacenaphthylen-3-ylsulfonyl)-1-piperazinyl]-4-methyl-6-(1-piperidinyl)pyrimidine IUPAC Name: 2-[4-(1,2-dihydroacenaphthylen-3-ylsulfonyl)piperazin-1-yl]-4-methyl-6-piperidin-1-ylpyrimidine Traditional Name: 2-(4-acenaphthen-3-ylsulfonylpiperazino)-4-methyl-6-piperidino-pyrimidine Formula: C26H31N5O2S MolecularWeight: 477.62164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=C4CCC5=CC=CC(=C54)C=C3)N6CCCCC6

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)S(=O)(=O)C3=C4CCC5=CC=CC(=C54)C=C3)N6CCCCC6

InChI

InChI=1S/C26H31N5O2S/c1-19-18-24(29-12-3-2-4-13-29)28-26(27-19)30-14-16-31(17-15-30)34(32,33)23-11-9-21-7-5-6-20-8-10-22(23)25(20)21/h5-7,9,11,18H,2-4,8,10,12-17H2,1H3