2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-[(4-imidazol-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-[(4-imidazol-1-ylphenyl)methyl]ethanamide Openeye Name: 2-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-[(4-imidazol-1-ylphenyl)methyl]acetamide CAS Name: 2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[[4-(1-imidazolyl)phenyl]methyl]acetamide IUPAC Name: 2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[(4-imidazol-1-ylphenyl)methyl]acetamide Traditional Name: 2-(3-chloro-N-mesyl-4-methoxy-anilino)-N-(4-imidazol-1-ylbenzyl)acetamide Formula: C20H21ClN4O4S MolecularWeight: 448.92314

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O4S/c1-29-19-8-7-17(11-18(19)21)25(30(2,27)28)13-20(26)23-12-15-3-5-16(6-4-15)24-10-9-22-14-24/h3-11,14H,12-13H2,1-2H3,(H,23,26)