N-[6-ethoxy-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfonyl-ethanamide

Systemtic Name: N-[6-ethoxy-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfonyl-ethanamide Openeye Name: N-[6-ethoxy-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfonyl-acetamide CAS Name: N-[6-ethoxy-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]sulfonylacetamide IUPAC Name: N-[6-ethoxy-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfonylacetamide Traditional Name: N-[6-ethoxy-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-keto-2-(4-phenylpiperazino)ethyl]sulfonyl-acetamide Formula: C27H34N4O6S2 MolecularWeight: 574.71206

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)OCC)SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)OCC)SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H34N4O6S2/c1-3-36-17-16-31-23-11-10-22(37-4-2)18-24(23)38-27(31)28-25(32)19-39(34,35)20-26(33)30-14-12-29(13-15-30)21-8-6-5-7-9-21/h5-11,18H,3-4,12-17,19-20H2,1-2H3