propan-2-yl 4-[methyl-[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[methyl-[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylate Openeye Name: isopropyl 4-[methyl-[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylate CAS Name: 4-[methyl-[[5-(4-methylsulfonylphenyl)-2-pyrazinyl]methyl]amino]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[methyl-[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[5-(4-mesylphenyl)pyrazin-2-yl]methyl-methyl-amino]piperidine-1-carboxylic acid isopropyl ester Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)N(C)CC2=NC=C(N=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)N(C)CC2=NC=C(N=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H30N4O4S/c1-16(2)30-22(27)26-11-9-19(10-12-26)25(3)15-18-13-24-21(14-23-18)17-5-7-20(8-6-17)31(4,28)29/h5-8,13-14,16,19H,9-12,15H2,1-4H3