(E)-N-(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)-3-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)prop-2-enamide Openeye Name: (E)-N-(2-amino-2-oxo-1-phenyl-ethyl)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)prop-2-enamide CAS Name: (E)-N-(2-amino-2-oxo-1-phenylethyl)-3-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(2-amino-2-oxo-1-phenylethyl)-3-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-N-(2-amino-2-keto-1-phenyl-ethyl)-3-(4-methoxy-3-morpholinosulfonyl-phenyl)acrylamide Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC(C2=CC=CC=C2)C(=O)N)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC(C2=CC=CC=C2)C(=O)N)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H25N3O6S/c1-30-18-9-7-16(15-19(18)32(28,29)25-11-13-31-14-12-25)8-10-20(26)24-21(22(23)27)17-5-3-2-4-6-17/h2-10,15,21H,11-14H2,1H3,(H2,23,27)(H,24,26)/b10-8+