(1-methylcyclopropyl) 4-[[5-[4-(3-cyanopropylsulfonyl)piperazin-1-yl]pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: (1-methylcyclopropyl) 4-[[5-[4-(3-cyanopropylsulfonyl)piperazin-1-yl]pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: (1-methylcyclopropyl) 4-[[5-[4-(3-cyanopropylsulfonyl)piperazin-1-yl]pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[5-[4-(3-cyanopropylsulfonyl)-1-piperazinyl]-2-pyrazinyl]oxymethyl]-1-piperidinecarboxylic acid (1-methylcyclopropyl) ester IUPAC Name: (1-methylcyclopropyl) 4-[[5-[4-(3-cyanopropylsulfonyl)piperazin-1-yl]pyrazin-2-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[5-[4-(3-cyanopropylsulfonyl)piperazino]pyrazin-2-yl]oxymethyl]piperidine-1-carboxylic acid (1-methylcyclopropyl) ester Formula: C23H34N6O5S MolecularWeight: 506.61826

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1)OC(=O)N2CCC(CC2)COC3=NC=C(N=C3)N4CCN(CC4)S(=O)(=O)CCCC#N

Isomeric SMILES

CC1(CC1)OC(=O)N2CCC(CC2)COC3=NC=C(N=C3)N4CCN(CC4)S(=O)(=O)CCCC#N

InChI

InChI=1S/C23H34N6O5S/c1-23(6-7-23)34-22(30)28-9-4-19(5-10-28)18-33-21-17-25-20(16-26-21)27-11-13-29(14-12-27)35(31,32)15-3-2-8-24/h16-17,19H,2-7,9-15,18H2,1H3