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

Systemtic Name: (E)-3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[(3-methoxyphenyl)methyl]-N-methyl-prop-2-enamide Openeye Name: (E)-3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[(3-methoxyphenyl)methyl]-N-methyl-prop-2-enamide CAS Name: (E)-3-[4-(1-azepanylsulfonyl)phenyl]-N-[(3-methoxyphenyl)methyl]-N-methyl-2-propenamide IUPAC Name: (E)-3-[4-(azepan-1-ylsulfonyl)phenyl]-N-[(3-methoxyphenyl)methyl]-N-methylprop-2-enamide Traditional Name: (E)-3-[4-(azepan-1-ylsulfonyl)phenyl]-N-m-anisyl-N-methyl-acrylamide Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)OC)C(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(CC1=CC(=CC=C1)OC)C(=O)/C=C/C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H30N2O4S/c1-25(19-21-8-7-9-22(18-21)30-2)24(27)15-12-20-10-13-23(14-11-20)31(28,29)26-16-5-3-4-6-17-26/h7-15,18H,3-6,16-17,19H2,1-2H3/b15-12+