3-[3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one

Systemtic Name: 3-[3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one Openeye Name: 3-[3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-oxo-propyl]quinazolin-4-one CAS Name: 3-[3-[4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-3-oxopropyl]-4-quinazolinone IUPAC Name: 3-[3-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]quinazolin-4-one Traditional Name: 3-[3-[4-(2-chlorophenyl)sulfonylpiperazino]-3-keto-propyl]quinazolin-4-one Formula: C21H21ClN4O4S MolecularWeight: 460.93384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCN2C=NC3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCN2C=NC3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H21ClN4O4S/c22-17-6-2-4-8-19(17)31(29,30)26-13-11-24(12-14-26)20(27)9-10-25-15-23-18-7-3-1-5-16(18)21(25)28/h1-8,15H,9-14H2