2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)-2-oxidanylidene-ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)-2-oxidanylidene-ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)-2-oxo-acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-2-oxoacetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-methyl-1,3-benzothiazol-2-yl)-2-oxoacetamide Traditional Name: 2-keto-N-(4-methyl-1,3-benzothiazol-2-yl)-2-(4-piperonylpiperazino)acetamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H22N4O4S/c1-14-3-2-4-18-19(14)23-22(31-18)24-20(27)21(28)26-9-7-25(8-10-26)12-15-5-6-16-17(11-15)30-13-29-16/h2-6,11H,7-10,12-13H2,1H3,(H,23,24,27)