4-(1,3-benzoxazol-2-ylsulfanylmethyl)-7-methoxy-3,4-dihydrochromen-2-one

Systemtic Name: 4-(1,3-benzoxazol-2-ylsulfanylmethyl)-7-methoxy-3,4-dihydrochromen-2-one Openeye Name: 4-(1,3-benzoxazol-2-ylsulfanylmethyl)-7-methoxy-chroman-2-one CAS Name: 4-[(1,3-benzoxazol-2-ylthio)methyl]-7-methoxy-3,4-dihydro-2H-1-benzopyran-2-one IUPAC Name: 4-(1,3-benzoxazol-2-ylsulfanylmethyl)-7-methoxy-3,4-dihydrochromen-2-one Traditional Name: 4-[(1,3-benzoxazol-2-ylthio)methyl]-7-methoxy-chroman-2-one Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(CC(=O)O2)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC2=C(C=C1)C(CC(=O)O2)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C18H15NO4S/c1-21-12-6-7-13-11(8-17(20)22-16(13)9-12)10-24-18-19-14-4-2-3-5-15(14)23-18/h2-7,9,11H,8,10H2,1H3