ethyl 2-cyano-4-phenyl-1-(phenylcarbonyl)quinazoline-2-carbodithioate

Systemtic Name: ethyl 2-cyano-4-phenyl-1-(phenylcarbonyl)quinazoline-2-carbodithioate Openeye Name: ethyl 1-benzoyl-2-cyano-4-phenyl-quinazoline-2-carbodithioate CAS Name: 1-benzoyl-2-cyano-4-phenyl-2-quinazolinecarbodithioic acid ethyl ester IUPAC Name: ethyl 1-benzoyl-2-cyano-4-phenylquinazoline-2-carbodithioate Traditional Name: 1-benzoyl-2-cyano-4-phenyl-quinazoline-2-carbodithioic acid ethyl ester Formula: C25H19N3OS2 MolecularWeight: 441.56786

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=S)C1(N=C(C2=CC=CC=C2N1C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CCSC(=S)C1(N=C(C2=CC=CC=C2N1C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H19N3OS2/c1-2-31-24(30)25(17-26)27-22(18-11-5-3-6-12-18)20-15-9-10-16-21(20)28(25)23(29)19-13-7-4-8-14-19/h3-16H,2H2,1H3