3-[[4-(phenylmethyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzothiazole-2-thione

Systemtic Name: 3-[[4-(phenylmethyl)sulfonylpiperazin-1-yl]methyl]-1,3-benzothiazole-2-thione Openeye Name: 3-[(4-benzylsulfonylpiperazin-1-yl)methyl]-1,3-benzothiazole-2-thione CAS Name: 3-[[4-(phenylmethyl)sulfonyl-1-piperazinyl]methyl]-1,3-benzothiazole-2-thione IUPAC Name: 3-[(4-benzylsulfonylpiperazin-1-yl)methyl]-1,3-benzothiazole-2-thione Traditional Name: 3-[(4-benzylsulfonylpiperazino)methyl]-1,3-benzothiazole-2-thione Formula: C19H21N3O2S3 MolecularWeight: 419.58394

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=CC=CC=C3SC2=S)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CN2C3=CC=CC=C3SC2=S)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C19H21N3O2S3/c23-27(24,14-16-6-2-1-3-7-16)21-12-10-20(11-13-21)15-22-17-8-4-5-9-18(17)26-19(22)25/h1-9H,10-15H2