N-(1,3-benzodioxol-5-ylmethyl)-3-[(2-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]-N-methyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(2-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]-N-methyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[2-methoxy-N-(p-tolylsulfonyl)anilino]-N-methyl-propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxy-N-(4-methylphenyl)sulfonylanilino)-N-methylpropanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-methoxy-N-(4-methylphenyl)sulfonylanilino)-N-methylpropanamide Traditional Name: 3-(2-methoxy-N-tosyl-anilino)-N-methyl-N-piperonyl-propionamide Formula: C26H28N2O6S MolecularWeight: 496.57532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N(C)CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N(C)CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4OC

InChI

InChI=1S/C26H28N2O6S/c1-19-8-11-21(12-9-19)35(30,31)28(22-6-4-5-7-23(22)32-3)15-14-26(29)27(2)17-20-10-13-24-25(16-20)34-18-33-24/h4-13,16H,14-15,17-18H2,1-3H3