3-(2-chlorophenyl)-2-(7,8,9,10-tetrahydrophenanthridin-6-ylsulfanylmethyl)quinazolin-4-one

Systemtic Name: 3-(2-chlorophenyl)-2-(7,8,9,10-tetrahydrophenanthridin-6-ylsulfanylmethyl)quinazolin-4-one Openeye Name: 3-(2-chlorophenyl)-2-(7,8,9,10-tetrahydrophenanthridin-6-ylsulfanylmethyl)quinazolin-4-one CAS Name: 3-(2-chlorophenyl)-2-[(7,8,9,10-tetrahydrophenanthridin-6-ylthio)methyl]-4-quinazolinone IUPAC Name: 3-(2-chlorophenyl)-2-(7,8,9,10-tetrahydrophenanthridin-6-ylsulfanylmethyl)quinazolin-4-one Traditional Name: 3-(2-chlorophenyl)-2-[(7,8,9,10-tetrahydrophenanthridin-6-ylthio)methyl]quinazolin-4-one Formula: C28H22ClN3OS MolecularWeight: 484.01178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6Cl

Isomeric SMILES

C1CCC2=C(C1)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6Cl

InChI

InChI=1S/C28H22ClN3OS/c29-22-13-5-8-16-25(22)32-26(30-24-15-7-4-12-21(24)28(32)33)17-34-27-20-11-2-1-9-18(20)19-10-3-6-14-23(19)31-27/h3-8,10,12-16H,1-2,9,11,17H2