6,7-dimethoxy-2-[(phenylmethylsulfanyl)methyl]-3,1-benzoxazin-4-one

Systemtic Name: 6,7-dimethoxy-2-[(phenylmethylsulfanyl)methyl]-3,1-benzoxazin-4-one Openeye Name: 2-(benzylsulfanylmethyl)-6,7-dimethoxy-3,1-benzoxazin-4-one CAS Name: 6,7-dimethoxy-2-[(phenylmethylthio)methyl]-3,1-benzoxazin-4-one IUPAC Name: 2-(benzylsulfanylmethyl)-6,7-dimethoxy-3,1-benzoxazin-4-one Traditional Name: 2-[(benzylthio)methyl]-6,7-dimethoxy-3,1-benzoxazin-4-one Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)OC(=N2)CSCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)OC(=N2)CSCC3=CC=CC=C3)OC

InChI

InChI=1S/C18H17NO4S/c1-21-15-8-13-14(9-16(15)22-2)19-17(23-18(13)20)11-24-10-12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3