butyl 4-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl-methyl-amino]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl-methyl-amino]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[(3,5-dimethylisoxazol-4-yl)sulfonyl-methyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(3,5-dimethyl-4-isoxazolyl)sulfonyl-methylamino]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl-methylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(3,5-dimethylisoxazol-4-yl)sulfonyl-methyl-amino]acetyl]amino]benzoic acid butyl ester Formula: C19H25N3O6S MolecularWeight: 423.4833

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C)S(=O)(=O)C2=C(ON=C2C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C)S(=O)(=O)C2=C(ON=C2C)C

InChI

InChI=1S/C19H25N3O6S/c1-5-6-11-27-19(24)15-7-9-16(10-8-15)20-17(23)12-22(4)29(25,26)18-13(2)21-28-14(18)3/h7-10H,5-6,11-12H2,1-4H3,(H,20,23)