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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-3-[(4-methyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-3-(4-methylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-3-(4-methylpiperazino)sulfonyl-benzamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C

InChI

InChI=1S/C21H24N4O3S2/c1-3-25(21-22-18-9-4-5-10-19(18)29-21)20(26)16-7-6-8-17(15-16)30(27,28)24-13-11-23(2)12-14-24/h4-10,15H,3,11-14H2,1-2H3