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

Systemtic Name: 2-[(3,4-dimethoxyphenyl)-methylsulfonyl-amino]-N-[(4-imidazol-1-ylphenyl)methyl]ethanamide Openeye Name: 2-(3,4-dimethoxy-N-methylsulfonyl-anilino)-N-[(4-imidazol-1-ylphenyl)methyl]acetamide CAS Name: 2-(3,4-dimethoxy-N-methylsulfonylanilino)-N-[[4-(1-imidazolyl)phenyl]methyl]acetamide IUPAC Name: 2-(3,4-dimethoxy-N-methylsulfonylanilino)-N-[(4-imidazol-1-ylphenyl)methyl]acetamide Traditional Name: N-(4-imidazol-1-ylbenzyl)-2-(N-mesyl-3,4-dimethoxy-anilino)acetamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC(=O)NCC2=CC=C(C=C2)N3C=CN=C3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC(=O)NCC2=CC=C(C=C2)N3C=CN=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C21H24N4O5S/c1-29-19-9-8-18(12-20(19)30-2)25(31(3,27)28)14-21(26)23-13-16-4-6-17(7-5-16)24-11-10-22-15-24/h4-12,15H,13-14H2,1-3H3,(H,23,26)