butyl 2-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: butyl 2-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: butyl 2-[(5-methyl-3-phenyl-isoxazole-4-carbonyl)amino]benzothiophene-3-carboxylate CAS Name: 2-[[(5-methyl-3-phenyl-4-isoxazolyl)-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid butyl ester IUPAC Name: butyl 2-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[(5-methyl-3-phenyl-isoxazole-4-carbonyl)amino]benzothiophene-3-carboxylic acid butyl ester Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=C(ON=C3C4=CC=CC=C4)C

Isomeric SMILES

CCCCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3=C(ON=C3C4=CC=CC=C4)C

InChI

InChI=1S/C24H22N2O4S/c1-3-4-14-29-24(28)20-17-12-8-9-13-18(17)31-23(20)25-22(27)19-15(2)30-26-21(19)16-10-6-5-7-11-16/h5-13H,3-4,14H2,1-2H3,(H,25,27)