2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(pyridin-4-ylmethyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(mesyl)amino]-N-(4-pyridylmethyl)acetamide Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1=CC=NC=C1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1=CC=NC=C1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H17N3O5S/c1-25(21,22)19(13-2-3-14-15(8-13)24-11-23-14)10-16(20)18-9-12-4-6-17-7-5-12/h2-8H,9-11H2,1H3,(H,18,20)