2-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 2-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-[(1-butyltetrazol-5-yl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide CAS Name: 2-[(1-butyl-5-tetrazolyl)methylthio]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[(1-butyltetrazol-5-yl)methylsulfanyl]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[(1-butyltetrazol-5-yl)methylthio]-N-(4-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide Formula: C20H22N6O4S2 MolecularWeight: 474.55648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CSC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CCCCN1C(=NN=N1)CSC2=NC3=C(O2)C=CC(=C3)S(=O)(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C20H22N6O4S2/c1-3-4-11-26-19(22-24-25-26)13-31-20-21-17-12-16(9-10-18(17)30-20)32(27,28)23-14-5-7-15(29-2)8-6-14/h5-10,12,23H,3-4,11,13H2,1-2H3