5-(4H-3,1-benzothiazin-2-ylsulfanylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-(4H-3,1-benzothiazin-2-ylsulfanylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-(4H-3,1-benzothiazin-2-ylsulfanylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[(4H-3,1-benzothiazin-2-ylthio)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-(4H-3,1-benzothiazin-2-ylsulfanylmethyl)-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[(4H-3,1-benzothiazin-2-ylthio)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4CS3)OC

InChI

InChI=1S/C19H17N3O3S2/c1-23-15-8-7-12(9-16(15)24-2)18-21-17(25-22-18)11-27-19-20-14-6-4-3-5-13(14)10-26-19/h3-9H,10-11H2,1-2H3