N-[4-[(E)-2-cyano-3-(2,4-dimethylphenyl)prop-2-enoyl]phenyl]propane-1-sulfonamide

Systemtic Name: N-[4-[(E)-2-cyano-3-(2,4-dimethylphenyl)prop-2-enoyl]phenyl]propane-1-sulfonamide Openeye Name: N-[4-[(E)-2-cyano-3-(2,4-dimethylphenyl)prop-2-enoyl]phenyl]propane-1-sulfonamide CAS Name: N-[4-[(E)-2-cyano-3-(2,4-dimethylphenyl)-1-oxoprop-2-enyl]phenyl]-1-propanesulfonamide IUPAC Name: N-[4-[(E)-2-cyano-3-(2,4-dimethylphenyl)prop-2-enoyl]phenyl]propane-1-sulfonamide Traditional Name: N-[4-[(E)-2-cyano-3-(2,4-dimethylphenyl)acryloyl]phenyl]propane-1-sulfonamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1=CC=C(C=C1)C(=O)C(=CC2=C(C=C(C=C2)C)C)C#N

Isomeric SMILES

CCCS(=O)(=O)NC1=CC=C(C=C1)C(=O)/C(=C/C2=C(C=C(C=C2)C)C)/C#N

InChI

InChI=1S/C21H22N2O3S/c1-4-11-27(25,26)23-20-9-7-17(8-10-20)21(24)19(14-22)13-18-6-5-15(2)12-16(18)3/h5-10,12-13,23H,4,11H2,1-3H3/b19-13+