N-[(S)-1,3-benzodioxol-5-yl(cyano)methyl]-4-methyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-[(S)-1,3-benzodioxol-5-yl(cyano)methyl]-4-methyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-[(S)-1,3-benzodioxol-5-yl(cyano)methyl]-N-benzyl-4-methyl-benzenesulfonamide CAS Name: N-[(S)-1,3-benzodioxol-5-yl(cyano)methyl]-4-methyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-[(S)-1,3-benzodioxol-5-yl(cyano)methyl]-N-benzyl-4-methylbenzenesulfonamide Traditional Name: N-[(S)-1,3-benzodioxol-5-yl(cyano)methyl]-N-benzyl-4-methyl-benzenesulfonamide Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C(C#N)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)[C@H](C#N)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H20N2O4S/c1-17-7-10-20(11-8-17)30(26,27)25(15-18-5-3-2-4-6-18)21(14-24)19-9-12-22-23(13-19)29-16-28-22/h2-13,21H,15-16H2,1H3/t21-/m1/s1