2-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-methylphenyl)propan-1-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-methylphenyl)propan-1-one Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(p-tolyl)propan-1-one CAS Name: 2-(1,3-benzothiazol-2-ylthio)-1-(4-methylphenyl)-1-propanone IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-methylphenyl)propan-1-one Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-1-(p-tolyl)propan-1-one Formula: C17H15NOS2 MolecularWeight: 313.4371

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H15NOS2/c1-11-7-9-13(10-8-11)16(19)12(2)20-17-18-14-5-3-4-6-15(14)21-17/h3-10,12H,1-2H3