(E)-3-(4-methoxyphenyl)-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(4-methoxyphenyl)-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]prop-2-enamide Openeye Name: (E)-3-(4-methoxyphenyl)-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]prop-2-enamide CAS Name: (E)-3-(4-methoxyphenyl)-N-[[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(4-methoxyphenyl)-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]prop-2-enamide Traditional Name: (E)-3-(4-methoxyphenyl)-N-(4-pyrrolidinosulfonylbenzyl)acrylamide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H24N2O4S/c1-27-19-9-4-17(5-10-19)8-13-21(24)22-16-18-6-11-20(12-7-18)28(25,26)23-14-2-3-15-23/h4-13H,2-3,14-16H2,1H3,(H,22,24)/b13-8+