N-[4-[(E)-2-cyano-3-[4-(dimethylamino)-2-methyl-phenyl]prop-2-enoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[(E)-2-cyano-3-[4-(dimethylamino)-2-methyl-phenyl]prop-2-enoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[(E)-2-cyano-3-[4-(dimethylamino)-2-methyl-phenyl]prop-2-enoyl]phenyl]methanesulfonamide CAS Name: N-[4-[(E)-2-cyano-3-[4-(dimethylamino)-2-methylphenyl]-1-oxoprop-2-enyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[(E)-2-cyano-3-[4-(dimethylamino)-2-methylphenyl]prop-2-enoyl]phenyl]methanesulfonamide Traditional Name: N-[4-[(E)-2-cyano-3-[4-(dimethylamino)-2-methyl-phenyl]acryloyl]phenyl]methanesulfonamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(C)C)C=C(C#N)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)N(C)C)/C=C(\C#N)/C(=O)C2=CC=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C20H21N3O3S/c1-14-11-19(23(2)3)10-7-16(14)12-17(13-21)20(24)15-5-8-18(9-6-15)22-27(4,25)26/h5-12,22H,1-4H3/b17-12+