N-[(3,4-dimethoxyphenyl)methyl]-4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-methyl-butanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-[(2,5-dimethylphenyl)-methylsulfonyl-amino]-N-methyl-butanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(2,5-dimethyl-N-methylsulfonyl-anilino)-N-methyl-butanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(2,5-dimethyl-N-methylsulfonylanilino)-N-methylbutanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(2,5-dimethyl-N-methylsulfonylanilino)-N-methylbutanamide Traditional Name: 4-(N-mesyl-2,5-dimethyl-anilino)-N-methyl-N-veratryl-butyramide Formula: C23H32N2O5S MolecularWeight: 448.57558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CCCC(=O)N(C)CC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CCCC(=O)N(C)CC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C

InChI

InChI=1S/C23H32N2O5S/c1-17-9-10-18(2)20(14-17)25(31(6,27)28)13-7-8-23(26)24(3)16-19-11-12-21(29-4)22(15-19)30-5/h9-12,14-15H,7-8,13,16H2,1-6H3