N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(phenylmethyl)-thiophen-2-ylsulfonyl-amino]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(phenylmethyl)-thiophen-2-ylsulfonyl-amino]ethanamide Openeye Name: 2-[benzyl(2-thienylsulfonyl)amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(phenylmethyl)-thiophen-2-ylsulfonylamino]acetamide IUPAC Name: 2-[benzyl(thiophen-2-ylsulfonyl)amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: 2-[benzyl(2-thienylsulfonyl)amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C21H20N2O5S2 MolecularWeight: 444.5239

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CN(CC3=CC=CC=C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H20N2O5S2/c24-20(22-17-8-9-18-19(13-17)28-11-10-27-18)15-23(14-16-5-2-1-3-6-16)30(25,26)21-7-4-12-29-21/h1-9,12-13H,10-11,14-15H2,(H,22,24)