2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[(4-imidazol-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[(4-imidazol-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[(4-imidazol-1-ylphenyl)methyl]acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[[4-(1-imidazolyl)phenyl]methyl]acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[(4-imidazol-1-ylphenyl)methyl]acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(mesyl)amino]-N-(4-imidazol-1-ylbenzyl)acetamide Formula: C20H20N4O5S MolecularWeight: 428.4616

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1=CC=C(C=C1)N2C=CN=C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1=CC=C(C=C1)N2C=CN=C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N4O5S/c1-30(26,27)24(17-6-7-18-19(10-17)29-14-28-18)12-20(25)22-11-15-2-4-16(5-3-15)23-9-8-21-13-23/h2-10,13H,11-12,14H2,1H3,(H,22,25)