N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-[(4-phenyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-phenylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-3-(4-phenylpiperazino)sulfonyl-benzamide Formula: C25H24N4O5S3 MolecularWeight: 556.67686

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N4O5S3/c1-36(31,32)20-10-11-22-23(17-20)35-25(26-22)27-24(30)18-6-5-9-21(16-18)37(33,34)29-14-12-28(13-15-29)19-7-3-2-4-8-19/h2-11,16-17H,12-15H2,1H3,(H,26,27,30)