N-[(3,4-dimethoxyphenyl)methyl]-3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-3-[N-(p-tolylsulfonyl)anilino]propanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(N-(4-methylphenyl)sulfonylanilino)propanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(N-(4-methylphenyl)sulfonylanilino)propanamide Traditional Name: 3-(N-tosylanilino)-N-veratryl-propionamide Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NCC2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NCC2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O5S/c1-19-9-12-22(13-10-19)33(29,30)27(21-7-5-4-6-8-21)16-15-25(28)26-18-20-11-14-23(31-2)24(17-20)32-3/h4-14,17H,15-16,18H2,1-3H3,(H,26,28)