N-(3-bromophenyl)-2-[2-(2,3-dimethylpiperidin-1-yl)ethyl]-2H-1,3-benzothiazole-3-carbothioamide

Systemtic Name: N-(3-bromophenyl)-2-[2-(2,3-dimethylpiperidin-1-yl)ethyl]-2H-1,3-benzothiazole-3-carbothioamide Openeye Name: N-(3-bromophenyl)-2-[2-(2,3-dimethyl-1-piperidyl)ethyl]-2H-1,3-benzothiazole-3-carbothioamide CAS Name: N-(3-bromophenyl)-2-[2-(2,3-dimethyl-1-piperidinyl)ethyl]-2H-1,3-benzothiazole-3-carbothioamide IUPAC Name: N-(3-bromophenyl)-2-[2-(2,3-dimethylpiperidin-1-yl)ethyl]-2H-1,3-benzothiazole-3-carbothioamide Traditional Name: N-(3-bromophenyl)-2-[2-(2,3-dimethylpiperidino)ethyl]-2H-1,3-benzothiazole-3-carbothioamide Formula: C23H28BrN3S2 MolecularWeight: 490.52252

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1C)CCC2N(C3=CC=CC=C3S2)C(=S)NC4=CC(=CC=C4)Br

Isomeric SMILES

CC1CCCN(C1C)CCC2N(C3=CC=CC=C3S2)C(=S)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C23H28BrN3S2/c1-16-7-6-13-26(17(16)2)14-12-22-27(20-10-3-4-11-21(20)29-22)23(28)25-19-9-5-8-18(24)15-19/h3-5,8-11,15-17,22H,6-7,12-14H2,1-2H3,(H,25,28)