2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-[(2-imidazol-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-[(2-imidazol-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-[(2-imidazol-1-ylphenyl)methyl]acetamide CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-[[2-(1-imidazolyl)phenyl]methyl]acetamide IUPAC Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(methylsulfonyl)amino]-N-[(2-imidazol-1-ylphenyl)methyl]acetamide Traditional Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(mesyl)amino]-N-(2-imidazol-1-ylbenzyl)acetamide Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1=CC=CC=C1N2C=CN=C2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1=CC=CC=C1N2C=CN=C2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H22N4O5S/c1-31(27,28)25(17-6-7-19-20(12-17)30-11-10-29-19)14-21(26)23-13-16-4-2-3-5-18(16)24-9-8-22-15-24/h2-9,12,15H,10-11,13-14H2,1H3,(H,23,26)