3-[4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-oxidanylidene-butyl]quinazolin-4-one

Systemtic Name: 3-[4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-oxidanylidene-butyl]quinazolin-4-one Openeye Name: 3-[4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-oxo-butyl]quinazolin-4-one CAS Name: 3-[4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-oxobutyl]-4-quinazolinone IUPAC Name: 3-[4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-oxobutyl]quinazolin-4-one Traditional Name: 3-[4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-4-keto-butyl]quinazolin-4-one Formula: C23H25FN4O4S MolecularWeight: 472.532403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)CCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)CCCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C23H25FN4O4S/c24-18-8-10-19(11-9-18)33(31,32)28-14-4-13-26(15-16-28)22(29)7-3-12-27-17-25-21-6-2-1-5-20(21)23(27)30/h1-2,5-6,8-11,17H,3-4,7,12-16H2