potassium 3-[7-[4-(3-chlorophenyl)piperazin-1-yl]-7-oxidanylidene-heptyl]-2-sulfanylidene-quinazolin-1-id-4-one

Systemtic Name: potassium 3-[7-[4-(3-chlorophenyl)piperazin-1-yl]-7-oxidanylidene-heptyl]-2-sulfanylidene-quinazolin-1-id-4-one Openeye Name: potassium 3-[7-[4-(3-chlorophenyl)piperazin-1-yl]-7-oxo-heptyl]-2-thioxo-quinazolin-1-id-4-one CAS Name: potassium 3-[7-[4-(3-chlorophenyl)-1-piperazinyl]-7-oxoheptyl]-2-sulfanylidene-4-quinazolin-1-idone IUPAC Name: potassium 3-[7-[4-(3-chlorophenyl)piperazin-1-yl]-7-oxoheptyl]-2-sulfanylidenequinazolin-1-id-4-one Traditional Name: potassium 3-[7-[4-(3-chlorophenyl)piperazino]-7-keto-heptyl]-2-thioxo-quinazolin-1-id-4-one Formula: C25H28ClKN4O2S MolecularWeight: 523.13172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCCCCCN3C(=O)C4=CC=CC=C4[N-]C3=S.[K+]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCCCCCN3C(=O)C4=CC=CC=C4[N-]C3=S.[K+]

InChI

InChI=1S/C25H29ClN4O2S.K/c26-19-8-7-9-20(18-19)28-14-16-29(17-15-28)23(31)12-3-1-2-6-13-30-24(32)21-10-4-5-11-22(21)27-25(30)33;/h4-5,7-11,18H,1-3,6,12-17H2,(H,27,32,33);/q;+1/p-1