3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethylphenyl)propan-1-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethylphenyl)propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethylphenyl)propan-1-one CAS Name: 3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethylphenyl)-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethylphenyl)propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethylphenyl)propan-1-one Formula: C18H17NOS MolecularWeight: 295.39868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C18H17NOS/c1-12-7-8-14(11-13(12)2)16(20)9-10-18-19-15-5-3-4-6-17(15)21-18/h3-8,11H,9-10H2,1-2H3