N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxy-3-methyl-phenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxy-3-methyl-phenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxy-3-methyl-phenyl)sulfonyl-1,1-dioxo-thiolan-3-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxy-3-methylphenyl)sulfonyl-1,1-dioxo-3-thiolanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxy-3-methylphenyl)sulfonyl-1,1-dioxothiolan-3-amine Traditional Name: [1,1-diketo-4-(4-methoxy-3-methyl-phenyl)sulfonyl-thiolan-3-yl]-piperonyl-amine Formula: C20H23NO7S2 MolecularWeight: 453.52912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C2CS(=O)(=O)CC2NCC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)C2CS(=O)(=O)CC2NCC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C20H23NO7S2/c1-13-7-15(4-6-17(13)26-2)30(24,25)20-11-29(22,23)10-16(20)21-9-14-3-5-18-19(8-14)28-12-27-18/h3-8,16,20-21H,9-12H2,1-2H3