4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanylmethyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanylmethyl]-7-methoxy-chromen-2-one Openeye Name: 4-[(3,5-dimethylisoxazol-4-yl)methylsulfanylmethyl]-7-methoxy-chromen-2-one CAS Name: 4-[[(3,5-dimethyl-4-isoxazolyl)methylthio]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanylmethyl]-7-methoxychromen-2-one Traditional Name: 4-[[(3,5-dimethylisoxazol-4-yl)methylthio]methyl]-7-methoxy-coumarin Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C17H17NO4S/c1-10-15(11(2)22-18-10)9-23-8-12-6-17(19)21-16-7-13(20-3)4-5-14(12)16/h4-7H,8-9H2,1-3H3