(E)-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-fluorophenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-fluorophenyl)prop-2-enamide Openeye Name: (E)-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-fluorophenyl)prop-2-enamide CAS Name: (E)-N-[4-(1-azepanylsulfonyl)phenyl]-3-(4-fluorophenyl)-2-propenamide IUPAC Name: (E)-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-fluorophenyl)prop-2-enamide Traditional Name: (E)-N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(4-fluorophenyl)acrylamide Formula: C21H23FN2O3S MolecularWeight: 402.482323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C=CC3=CC=C(C=C3)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN2O3S/c22-18-8-5-17(6-9-18)7-14-21(25)23-19-10-12-20(13-11-19)28(26,27)24-15-3-1-2-4-16-24/h5-14H,1-4,15-16H2,(H,23,25)/b14-7+