2-[[4-(2-phenylethenylsulfonyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[4-(2-phenylethenylsulfonyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-styrylsulfonylpiperazin-1-yl)methyl]-1H-quinazolin-4-one CAS Name: 2-[[4-(2-phenylethenylsulfonyl)-1-piperazinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[4-(2-phenylethenylsulfonyl)piperazin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-styrylsulfonylpiperazino)methyl]-1H-quinazolin-4-one Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)C=CC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O3S/c26-21-18-8-4-5-9-19(18)22-20(23-21)16-24-11-13-25(14-12-24)29(27,28)15-10-17-6-2-1-3-7-17/h1-10,15H,11-14,16H2,(H,22,23,26)