(E)-3-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-1-(2-hydroxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-1-(2-hydroxyphenyl)prop-2-en-1-one Openeye Name: (E)-3-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-1-(2-hydroxyphenyl)prop-2-en-1-one CAS Name: (E)-3-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxyphenyl]-1-(2-hydroxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]-1-(2-hydroxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxy-phenyl]-1-(2-hydroxyphenyl)prop-2-en-1-one Formula: C24H19NO3S2 MolecularWeight: 433.54256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=CC=C2O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=CC=C2O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H19NO3S2/c1-28-22-13-11-16(10-12-21(27)18-6-2-4-8-20(18)26)14-17(22)15-29-24-25-19-7-3-5-9-23(19)30-24/h2-14,26H,15H2,1H3/b12-10+