2-[2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]ethanoylamino]-N-butan-2-yl-benzamide

Systemtic Name: 2-[2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]ethanoylamino]-N-butan-2-yl-benzamide Openeye Name: 2-[[2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]acetyl]amino]-N-sec-butyl-benzamide CAS Name: 2-[[2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-1-oxoethyl]amino]-N-butan-2-ylbenzamide IUPAC Name: 2-[[2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]acetyl]amino]-N-butan-2-ylbenzamide Traditional Name: 2-[[2-[1,3-benzodioxol-5-yl(mesyl)amino]acetyl]amino]-N-sec-butyl-benzamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C

InChI

InChI=1S/C21H25N3O6S/c1-4-14(2)22-21(26)16-7-5-6-8-17(16)23-20(25)12-24(31(3,27)28)15-9-10-18-19(11-15)30-13-29-18/h5-11,14H,4,12-13H2,1-3H3,(H,22,26)(H,23,25)