N-[2-(pyrazin-2-ylamino)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(pyrazin-2-ylamino)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(pyrazin-2-ylamino)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(2-pyrazinylamino)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(pyrazin-2-ylamino)ethyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-mesitylsulfonyl-N-[2-(pyrazin-2-ylamino)ethyl]isonipecotamide Formula: C21H29N5O3S MolecularWeight: 431.55166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCCNC3=NC=CN=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCCNC3=NC=CN=C3)C

InChI

InChI=1S/C21H29N5O3S/c1-15-12-16(2)20(17(3)13-15)30(28,29)26-10-4-18(5-11-26)21(27)25-9-8-24-19-14-22-6-7-23-19/h6-7,12-14,18H,4-5,8-11H2,1-3H3,(H,23,24)(H,25,27)