3-[3-oxidanylidene-3-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]propyl]quinazolin-4-one

Systemtic Name: 3-[3-oxidanylidene-3-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]propyl]quinazolin-4-one Openeye Name: 3-[3-oxo-3-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-1-yl]propyl]quinazolin-4-one CAS Name: 3-[3-oxo-3-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazinyl]propyl]-4-quinazolinone IUPAC Name: 3-[3-oxo-3-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]propyl]quinazolin-4-one Traditional Name: 3-[3-keto-3-[4-[(2-phenylthiazol-4-yl)methyl]piperazino]propyl]quinazolin-4-one Formula: C25H25N5O2S MolecularWeight: 459.5633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC(=N2)C3=CC=CC=C3)C(=O)CCN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCN1CC2=CSC(=N2)C3=CC=CC=C3)C(=O)CCN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C25H25N5O2S/c31-23(10-11-30-18-26-22-9-5-4-8-21(22)25(30)32)29-14-12-28(13-15-29)16-20-17-33-24(27-20)19-6-2-1-3-7-19/h1-9,17-18H,10-16H2