N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[(4-methyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-methylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-methylpiperazino)sulfonyl-benzamide Formula: C21H24N4O4S2 MolecularWeight: 460.56966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C

InChI

InChI=1S/C21H24N4O4S2/c1-3-29-16-7-8-18-19(14-16)30-21(22-18)23-20(26)15-5-4-6-17(13-15)31(27,28)25-11-9-24(2)10-12-25/h4-8,13-14H,3,9-12H2,1-2H3,(H,22,23,26)