[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2,1,3-benzothiadiazol-5-yl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2,1,3-benzothiadiazol-5-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2,1,3-benzothiadiazol-5-yl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(2,1,3-benzothiadiazol-5-yl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(2,1,3-benzothiadiazol-5-yl)methanone Traditional Name: piazthiol-5-yl-(4-piperonylpiperazino)methanone Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=NSN=C5C=C4

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=NSN=C5C=C4

InChI

InChI=1S/C19H18N4O3S/c24-19(14-2-3-15-16(10-14)21-27-20-15)23-7-5-22(6-8-23)11-13-1-4-17-18(9-13)26-12-25-17/h1-4,9-10H,5-8,11-12H2