3-(1,3-benzothiazol-2-ylsulfanyl)-1-(5-methoxy-2-oxidanyl-phenyl)propan-1-one

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(5-methoxy-2-oxidanyl-phenyl)propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(2-hydroxy-5-methoxy-phenyl)propan-1-one CAS Name: 3-(1,3-benzothiazol-2-ylthio)-1-(2-hydroxy-5-methoxyphenyl)-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(2-hydroxy-5-methoxyphenyl)propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-1-(2-hydroxy-5-methoxy-phenyl)propan-1-one Formula: C17H15NO3S2 MolecularWeight: 345.4359

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C(=O)CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC(=C(C=C1)O)C(=O)CCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H15NO3S2/c1-21-11-6-7-14(19)12(10-11)15(20)8-9-22-17-18-13-4-2-3-5-16(13)23-17/h2-7,10,19H,8-9H2,1H3