methyl 7-[(2,5-dimethylthiophen-3-yl)sulfonylamino]-2-(phenylmethyl)-1,3-benzoxazole-5-carboxylate

Systemtic Name: methyl 7-[(2,5-dimethylthiophen-3-yl)sulfonylamino]-2-(phenylmethyl)-1,3-benzoxazole-5-carboxylate Openeye Name: methyl 2-benzyl-7-[(2,5-dimethyl-3-thienyl)sulfonylamino]-1,3-benzoxazole-5-carboxylate CAS Name: 7-[(2,5-dimethyl-3-thiophenyl)sulfonylamino]-2-(phenylmethyl)-1,3-benzoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-7-[(2,5-dimethylthiophen-3-yl)sulfonylamino]-1,3-benzoxazole-5-carboxylate Traditional Name: 2-benzyl-7-[(2,5-dimethyl-3-thienyl)sulfonylamino]-1,3-benzoxazole-5-carboxylic acid methyl ester Formula: C22H20N2O5S2 MolecularWeight: 456.5346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)S(=O)(=O)NC2=CC(=CC3=C2OC(=N3)CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)C)S(=O)(=O)NC2=CC(=CC3=C2OC(=N3)CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C22H20N2O5S2/c1-13-9-19(14(2)30-13)31(26,27)24-18-12-16(22(25)28-3)11-17-21(18)29-20(23-17)10-15-7-5-4-6-8-15/h4-9,11-12,24H,10H2,1-3H3