4-ethylsulfonyl-N-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl]benzamide

Systemtic Name: 4-ethylsulfonyl-N-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl]benzamide Openeye Name: 4-ethylsulfonyl-N-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl]benzamide CAS Name: 4-ethylsulfonyl-N-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]ethyl]benzamide IUPAC Name: 4-ethylsulfonyl-N-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl]benzamide Traditional Name: 4-esyl-N-[2-[4-(6-methyl-1,3-benzothiazol-2-yl)piperazino]ethyl]benzamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCN2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCN2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)C

InChI

InChI=1S/C23H28N4O3S2/c1-3-32(29,30)19-7-5-18(6-8-19)22(28)24-10-11-26-12-14-27(15-13-26)23-25-20-9-4-17(2)16-21(20)31-23/h4-9,16H,3,10-15H2,1-2H3,(H,24,28)