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

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethoxyphenyl)propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethoxyphenyl)propan-1-one CAS Name: 3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethoxyphenyl)-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethoxyphenyl)propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-1-(3,4-dimethoxyphenyl)propan-1-one Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CCC2=NC3=CC=CC=C3S2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CCC2=NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C18H17NO3S/c1-21-15-9-7-12(11-16(15)22-2)14(20)8-10-18-19-13-5-3-4-6-17(13)23-18/h3-7,9,11H,8,10H2,1-2H3