N-[(4-bromophenyl)methyl]-N-cyclohexyl-3-methoxy-4-(1,2,3,4-tetrazol-1-yl)benzenesulfonamide

Systemtic Name: N-[(4-bromophenyl)methyl]-N-cyclohexyl-3-methoxy-4-(1,2,3,4-tetrazol-1-yl)benzenesulfonamide Openeye Name: N-[(4-bromophenyl)methyl]-N-cyclohexyl-3-methoxy-4-(tetrazol-1-yl)benzenesulfonamide CAS Name: N-[(4-bromophenyl)methyl]-N-cyclohexyl-3-methoxy-4-(1-tetrazolyl)benzenesulfonamide IUPAC Name: N-[(4-bromophenyl)methyl]-N-cyclohexyl-3-methoxy-4-(tetrazol-1-yl)benzenesulfonamide Traditional Name: N-(4-bromobenzyl)-N-cyclohexyl-3-methoxy-4-(tetrazol-1-yl)benzenesulfonamide Formula: C21H24BrN5O3S MolecularWeight: 506.41596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Br)C3CCCCC3)N4C=NN=N4

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Br)C3CCCCC3)N4C=NN=N4

InChI

InChI=1S/C21H24BrN5O3S/c1-30-21-13-19(11-12-20(21)26-15-23-24-25-26)31(28,29)27(18-5-3-2-4-6-18)14-16-7-9-17(22)10-8-16/h7-13,15,18H,2-6,14H2,1H3