4-methylidene-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1H-quinazolin-2-one

Systemtic Name: 4-methylidene-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1H-quinazolin-2-one Openeye Name: 4-methylene-3-[[2-(1-piperidylsulfonyl)phenyl]methyl]-1H-quinazolin-2-one CAS Name: 4-methylene-3-[[2-(1-piperidinylsulfonyl)phenyl]methyl]-1H-quinazolin-2-one IUPAC Name: 4-methylidene-3-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1H-quinazolin-2-one Traditional Name: 4-methylene-3-(2-piperidinosulfonylbenzyl)-1H-quinazolin-2-one Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2NC(=O)N1CC3=CC=CC=C3S(=O)(=O)N4CCCCC4

Isomeric SMILES

C=C1C2=CC=CC=C2NC(=O)N1CC3=CC=CC=C3S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H23N3O3S/c1-16-18-10-4-5-11-19(18)22-21(25)24(16)15-17-9-3-6-12-20(17)28(26,27)23-13-7-2-8-14-23/h3-6,9-12H,1-2,7-8,13-15H2,(H,22,25)