3-[4-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]carbonylphenyl]quinazolin-4-one

Systemtic Name: 3-[4-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]carbonylphenyl]quinazolin-4-one Openeye Name: 3-[4-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)phenyl]quinazolin-4-one CAS Name: 3-[4-[[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-oxomethyl]phenyl]-4-quinazolinone IUPAC Name: 3-[4-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazine-1-carbonyl]phenyl]quinazolin-4-one Traditional Name: 3-[4-(4-indan-5-ylsulfonylpiperazine-1-carbonyl)phenyl]quinazolin-4-one Formula: C28H26N4O4S MolecularWeight: 514.59544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)N5C=NC6=CC=CC=C6C5=O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)N5C=NC6=CC=CC=C6C5=O

InChI

InChI=1S/C28H26N4O4S/c33-27(21-8-11-23(12-9-21)32-19-29-26-7-2-1-6-25(26)28(32)34)30-14-16-31(17-15-30)37(35,36)24-13-10-20-4-3-5-22(20)18-24/h1-2,6-13,18-19H,3-5,14-17H2