3-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-N,N-diethyl-2-sulfanylidene-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 3-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-N,N-diethyl-2-sulfanylidene-1,3-benzoxazole-5-sulfonamide Openeye Name: 3-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-N,N-diethyl-2-thioxo-1,3-benzoxazole-5-sulfonamide CAS Name: 3-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]methyl]-N,N-diethyl-2-sulfanylidene-1,3-benzoxazole-5-sulfonamide IUPAC Name: 3-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]methyl]-N,N-diethyl-2-sulfanylidene-1,3-benzoxazole-5-sulfonamide Traditional Name: N,N-diethyl-3-[[homoveratryl(methyl)amino]methyl]-2-thioxo-1,3-benzoxazole-5-sulfonamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OC(=S)N2CN(C)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OC(=S)N2CN(C)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H31N3O5S2/c1-6-25(7-2)33(27,28)18-9-11-20-19(15-18)26(23(32)31-20)16-24(3)13-12-17-8-10-21(29-4)22(14-17)30-5/h8-11,14-15H,6-7,12-13,16H2,1-5H3