methyl 5-[(2-oxidanylidenechromen-3-yl)carbonylamino]-3-propoxy-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[(2-oxidanylidenechromen-3-yl)carbonylamino]-3-propoxy-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[(2-oxochromene-3-carbonyl)amino]-3-propoxy-benzothiophene-2-carboxylate CAS Name: 5-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]-3-propoxy-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[(2-oxochromene-3-carbonyl)amino]-3-propoxy-1-benzothiophene-2-carboxylate Traditional Name: 5-[(2-ketochromene-3-carbonyl)amino]-3-propoxy-benzothiophene-2-carboxylic acid methyl ester Formula: C23H19NO6S MolecularWeight: 437.46506

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(SC2=C1C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O)C(=O)OC

Isomeric SMILES

CCCOC1=C(SC2=C1C=C(C=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O)C(=O)OC

InChI

InChI=1S/C23H19NO6S/c1-3-10-29-19-15-12-14(8-9-18(15)31-20(19)23(27)28-2)24-21(25)16-11-13-6-4-5-7-17(13)30-22(16)26/h4-9,11-12H,3,10H2,1-2H3,(H,24,25)