4-(4-fluorophenyl)-5-phenyl-2-sulfanylidene-6,11-dihydropyrido[2,3-b][1,5]benzodiazepine-3-carbonitrile

Systemtic Name: 4-(4-fluorophenyl)-5-phenyl-2-sulfanylidene-6,11-dihydropyrido[2,3-b][1,5]benzodiazepine-3-carbonitrile Openeye Name: 4-(4-fluorophenyl)-5-phenyl-2-thioxo-6,11-dihydropyrido[2,3-b][1,5]benzodiazepine-3-carbonitrile CAS Name: 4-(4-fluorophenyl)-5-phenyl-2-sulfanylidene-6,11-dihydropyrido[2,3-b][1,5]benzodiazepine-3-carbonitrile IUPAC Name: 4-(4-fluorophenyl)-5-phenyl-2-sulfanylidene-6,11-dihydropyrido[2,3-b][1,5]benzodiazepine-3-carbonitrile Traditional Name: 4-(4-fluorophenyl)-5-phenyl-2-thioxo-6,11-dihydropyrido[2,3-b][1,5]benzodiazepine-3-carbonitrile Formula: C25H15FN4S MolecularWeight: 422.476803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(=C(C(=S)N=C3NC4=CC=CC=C4N2)C#N)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(=C(C(=S)N=C3NC4=CC=CC=C4N2)C#N)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H15FN4S/c26-17-12-10-15(11-13-17)21-18(14-27)25(31)30-24-22(21)23(16-6-2-1-3-7-16)28-19-8-4-5-9-20(19)29-24/h1-13,28H,(H,29,30,31)