N-pentan-2-yl-6-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]pyridine-3-sulfonamide

Systemtic Name: N-pentan-2-yl-6-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]pyridine-3-sulfonamide Openeye Name: N-(1-methylbutyl)-6-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]pyridine-3-sulfonamide CAS Name: N-pentan-2-yl-6-[[2-(1-pyrazolylmethyl)phenyl]methylamino]-3-pyridinesulfonamide IUPAC Name: N-pentan-2-yl-6-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]pyridine-3-sulfonamide Traditional Name: N-(1-methylbutyl)-6-[[2-(pyrazol-1-ylmethyl)benzyl]amino]pyridine-3-sulfonamide Formula: C21H27N5O2S MolecularWeight: 413.53638

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NS(=O)(=O)C1=CN=C(C=C1)NCC2=CC=CC=C2CN3C=CC=N3

Isomeric SMILES

CCCC(C)NS(=O)(=O)C1=CN=C(C=C1)NCC2=CC=CC=C2CN3C=CC=N3

InChI

InChI=1S/C21H27N5O2S/c1-3-7-17(2)25-29(27,28)20-10-11-21(23-15-20)22-14-18-8-4-5-9-19(18)16-26-13-6-12-24-26/h4-6,8-13,15,17,25H,3,7,14,16H2,1-2H3,(H,22,23)