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

Systemtic Name: (E)-N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: (E)-N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enamide CAS Name: (E)-N-[3-(1-azepanylsulfonyl)phenyl]-3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(4-methoxy-3-morpholinosulfonyl-phenyl)acrylamide Formula: C26H33N3O7S2 MolecularWeight: 563.68612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C26H33N3O7S2/c1-35-24-11-9-21(19-25(24)38(33,34)29-15-17-36-18-16-29)10-12-26(30)27-22-7-6-8-23(20-22)37(31,32)28-13-4-2-3-5-14-28/h6-12,19-20H,2-5,13-18H2,1H3,(H,27,30)/b12-10+