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

Systemtic Name: ethyl 4-[methyl-[[5-(4-methylsulfonylphenyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C21H28N4O4S MolecularWeight: 432.53642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O4S/c1-4-29-21(26)25-11-9-18(10-12-25)24(2)15-17-13-23-20(14-22-17)16-5-7-19(8-6-16)30(3,27)28/h5-8,13-14,18H,4,9-12,15H2,1-3H3