4-methoxy-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]naphthalene-1-sulfonamide

Systemtic Name: 4-methoxy-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]naphthalene-1-sulfonamide Openeye Name: 4-methoxy-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]naphthalene-1-sulfonamide CAS Name: 4-methoxy-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-1-naphthalenesulfonamide IUPAC Name: 4-methoxy-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]naphthalene-1-sulfonamide Traditional Name: 4-methoxy-N-[2-(1,2,4-triazol-1-ylmethyl)benzyl]naphthalene-1-sulfonamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C2=CC=CC=C21)S(=O)(=O)NCC3=CC=CC=C3CN4C=NC=N4

Isomeric SMILES

COC1=CC=C(C2=CC=CC=C21)S(=O)(=O)NCC3=CC=CC=C3CN4C=NC=N4

InChI

InChI=1S/C21H20N4O3S/c1-28-20-10-11-21(19-9-5-4-8-18(19)20)29(26,27)24-12-16-6-2-3-7-17(16)13-25-15-22-14-23-25/h2-11,14-15,24H,12-13H2,1H3