2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[4-(4-ethylpiperazino)-2-methyl-phenyl]acetamide Formula: C23H28N4OS2 MolecularWeight: 440.62462

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CSCC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CSCC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C23H28N4OS2/c1-3-26-10-12-27(13-11-26)18-8-9-19(17(2)14-18)24-22(28)15-29-16-23-25-20-6-4-5-7-21(20)30-23/h4-9,14H,3,10-13,15-16H2,1-2H3,(H,24,28)