2-[1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethyl]-1,3-benzothiazole

Systemtic Name: 2-[1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethyl]-1,3-benzothiazole Openeye Name: 2-[1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethyl]-1,3-benzothiazole CAS Name: 2-[1-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]ethyl]-1,3-benzothiazole IUPAC Name: 2-[1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethyl]-1,3-benzothiazole Traditional Name: 2-[1-[4-(3,4-dimethylphenyl)sulfonylpiperazino]ethyl]-1,3-benzothiazole Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H25N3O2S2/c1-15-8-9-18(14-16(15)2)28(25,26)24-12-10-23(11-13-24)17(3)21-22-19-6-4-5-7-20(19)27-21/h4-9,14,17H,10-13H2,1-3H3