N-[2-tert-butyl-5-(4-methylpiperazin-1-yl)-1,3-benzothiazol-4-yl]-4-ethanoyl-piperazine-1-carbothioamide

Systemtic Name: N-[2-tert-butyl-5-(4-methylpiperazin-1-yl)-1,3-benzothiazol-4-yl]-4-ethanoyl-piperazine-1-carbothioamide Openeye Name: 4-acetyl-N-[2-tert-butyl-5-(4-methylpiperazin-1-yl)-1,3-benzothiazol-4-yl]piperazine-1-carbothioamide CAS Name: 4-acetyl-N-[2-tert-butyl-5-(4-methyl-1-piperazinyl)-1,3-benzothiazol-4-yl]-1-piperazinecarbothioamide IUPAC Name: 4-acetyl-N-[2-tert-butyl-5-(4-methylpiperazin-1-yl)-1,3-benzothiazol-4-yl]piperazine-1-carbothioamide Traditional Name: 4-acetyl-N-[2-tert-butyl-5-(4-methylpiperazino)-1,3-benzothiazol-4-yl]piperazine-1-carbothioamide Formula: C23H34N6OS2 MolecularWeight: 474.68566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=S)NC2=C(C=CC3=C2N=C(S3)C(C)(C)C)N4CCN(CC4)C

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=S)NC2=C(C=CC3=C2N=C(S3)C(C)(C)C)N4CCN(CC4)C

InChI

InChI=1S/C23H34N6OS2/c1-16(30)27-12-14-29(15-13-27)22(31)25-19-17(28-10-8-26(5)9-11-28)6-7-18-20(19)24-21(32-18)23(2,3)4/h6-7H,8-15H2,1-5H3,(H,25,31)