2-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methyl]-6-chloranyl-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methyl]-6-chloranyl-1H-quinazolin-4-one Openeye Name: 2-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methyl]-6-chloro-1H-quinazolin-4-one CAS Name: 2-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]methyl]-6-chloro-1H-quinazolin-4-one IUPAC Name: 2-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]methyl]-6-chloro-1H-quinazolin-4-one Traditional Name: 6-chloro-2-[(4-piazthiol-4-ylsulfonylpiperazino)methyl]-1H-quinazolin-4-one Formula: C19H17ClN6O3S2 MolecularWeight: 476.95968

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=C(N2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=C(N2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C19H17ClN6O3S2/c20-12-4-5-14-13(10-12)19(27)22-17(21-14)11-25-6-8-26(9-7-25)31(28,29)16-3-1-2-15-18(16)24-30-23-15/h1-5,10H,6-9,11H2,(H,21,22,27)