tert-butyl 4-[methyl-[[5-(4-methylsulfinylphenyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[methyl-[[5-(4-methylsulfinylphenyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[methyl-[[5-(4-methylsulfinylphenyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylate CAS Name: 4-[methyl-[[5-(4-methylsulfinylphenyl)-2-pyrazinyl]methyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[methyl-[[5-(4-methylsulfinylphenyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylate Traditional Name: 4-[methyl-[[5-(4-methylsulfinylphenyl)pyrazin-2-yl]methyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N4O3S/c1-23(2,3)30-22(28)27-12-10-19(11-13-27)26(4)16-18-14-25-21(15-24-18)17-6-8-20(9-7-17)31(5)29/h6-9,14-15,19H,10-13,16H2,1-5H3