N-(3-oxidanylpropyl)-N-(2-phenylpyrazol-3-yl)-4-prop-2-enyl-benzenesulfonamide

Systemtic Name: N-(3-oxidanylpropyl)-N-(2-phenylpyrazol-3-yl)-4-prop-2-enyl-benzenesulfonamide Openeye Name: 4-allyl-N-(3-hydroxypropyl)-N-(2-phenylpyrazol-3-yl)benzenesulfonamide CAS Name: N-(3-hydroxypropyl)-N-(2-phenyl-3-pyrazolyl)-4-prop-2-enylbenzenesulfonamide IUPAC Name: N-(3-hydroxypropyl)-N-(2-phenylpyrazol-3-yl)-4-prop-2-enylbenzenesulfonamide Traditional Name: 4-allyl-N-(3-hydroxypropyl)-N-(2-phenylpyrazol-3-yl)benzenesulfonamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=C(C=C1)S(=O)(=O)N(CCCO)C2=CC=NN2C3=CC=CC=C3

Isomeric SMILES

C=CCC1=CC=C(C=C1)S(=O)(=O)N(CCCO)C2=CC=NN2C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3S/c1-2-7-18-10-12-20(13-11-18)28(26,27)23(16-6-17-25)21-14-15-22-24(21)19-8-4-3-5-9-19/h2-5,8-15,25H,1,6-7,16-17H2