N-[1-(4-cyanobutyl)pyrazol-4-yl]-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[1-(4-cyanobutyl)pyrazol-4-yl]-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[1-(4-cyanobutyl)pyrazol-4-yl]propanamide CAS Name: 3-(benzenesulfonyl)-N-[1-(4-cyanobutyl)-4-pyrazolyl]propanamide IUPAC Name: 3-(benzenesulfonyl)-N-[1-(4-cyanobutyl)pyrazol-4-yl]propanamide Traditional Name: 3-besyl-N-[1-(4-cyanobutyl)pyrazol-4-yl]propionamide Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=CN(N=C2)CCCCC#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=CN(N=C2)CCCCC#N

InChI

InChI=1S/C17H20N4O3S/c18-10-5-2-6-11-21-14-15(13-19-21)20-17(22)9-12-25(23,24)16-7-3-1-4-8-16/h1,3-4,7-8,13-14H,2,5-6,9,11-12H2,(H,20,22)