(E)-N-[4-(cyanomethyl)phenyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(cyanomethyl)phenyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-N-[4-(cyanomethyl)phenyl]-3-(4-morpholinosulfonylphenyl)prop-2-enamide CAS Name: (E)-N-[4-(cyanomethyl)phenyl]-3-[4-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-N-[4-(cyanomethyl)phenyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-N-[4-(cyanomethyl)phenyl]-3-(4-morpholinosulfonylphenyl)acrylamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C=CC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C21H21N3O4S/c22-12-11-18-1-6-19(7-2-18)23-21(25)10-5-17-3-8-20(9-4-17)29(26,27)24-13-15-28-16-14-24/h1-10H,11,13-16H2,(H,23,25)/b10-5+