(E)-N-[2-(azepan-1-yl)phenyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(azepan-1-yl)phenyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-N-[2-(azepan-1-yl)phenyl]-3-(4-morpholinosulfonylphenyl)prop-2-enamide CAS Name: (E)-N-[2-(1-azepanyl)phenyl]-3-[4-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-N-[2-(azepan-1-yl)phenyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(azepan-1-yl)phenyl]-3-(4-morpholinosulfonylphenyl)acrylamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)C=CC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)/C=C/C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H31N3O4S/c29-25(26-23-7-3-4-8-24(23)27-15-5-1-2-6-16-27)14-11-21-9-12-22(13-10-21)33(30,31)28-17-19-32-20-18-28/h3-4,7-14H,1-2,5-6,15-20H2,(H,26,29)/b14-11+