3-methyl-2-oxidanylidene-N-[(4-propylphenyl)-thiophen-2-yl-methyl]-1,3-benzoxazole-6-sulfonamide

Systemtic Name: 3-methyl-2-oxidanylidene-N-[(4-propylphenyl)-thiophen-2-yl-methyl]-1,3-benzoxazole-6-sulfonamide Openeye Name: 3-methyl-2-oxo-N-[(4-propylphenyl)-(2-thienyl)methyl]-1,3-benzoxazole-6-sulfonamide CAS Name: 3-methyl-2-oxo-N-[(4-propylphenyl)-thiophen-2-ylmethyl]-1,3-benzoxazole-6-sulfonamide IUPAC Name: 3-methyl-2-oxo-N-[(4-propylphenyl)-thiophen-2-ylmethyl]-1,3-benzoxazole-6-sulfonamide Traditional Name: 2-keto-3-methyl-N-[(4-propylphenyl)-(2-thienyl)methyl]-1,3-benzoxazole-6-sulfonamide Formula: C22H22N2O4S2 MolecularWeight: 442.55108

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)O4)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)O4)C

InChI

InChI=1S/C22H22N2O4S2/c1-3-5-15-7-9-16(10-8-15)21(20-6-4-13-29-20)23-30(26,27)17-11-12-18-19(14-17)28-22(25)24(18)2/h4,6-14,21,23H,3,5H2,1-2H3