N-(1,3-benzothiazol-2-yl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(1,3-benzothiazol-2-yl)benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-(1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-(1,3-benzothiazol-2-yl)benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-(1,3-benzothiazol-2-yl)benzamide Formula: C20H20N4O4S2 MolecularWeight: 444.5272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20N4O4S2/c1-14(25)23-9-11-24(12-10-23)30(27,28)16-6-4-5-15(13-16)19(26)22-20-21-17-7-2-3-8-18(17)29-20/h2-8,13H,9-12H2,1H3,(H,21,22,26)