N-[(3,4-dimethoxyphenyl)methyl]-4-(4-ethylphenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-amine

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(4-ethylphenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-amine Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(4-ethylphenyl)sulfonyl-1,1-dioxo-thiolan-3-amine CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(4-ethylphenyl)sulfonyl-1,1-dioxo-3-thiolanamine IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(4-ethylphenyl)sulfonyl-1,1-dioxothiolan-3-amine Traditional Name: [4-(4-ethylphenyl)sulfonyl-1,1-diketo-thiolan-3-yl]-veratryl-amine Formula: C21H27NO6S2 MolecularWeight: 453.57218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)C2CS(=O)(=O)CC2NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)C2CS(=O)(=O)CC2NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H27NO6S2/c1-4-15-5-8-17(9-6-15)30(25,26)21-14-29(23,24)13-18(21)22-12-16-7-10-19(27-2)20(11-16)28-3/h5-11,18,21-22H,4,12-14H2,1-3H3