7-[(2-chlorophenyl)methylcarbamoyl]-3-(2-fluorophenyl)-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-[(2-chlorophenyl)methylcarbamoyl]-3-(2-fluorophenyl)-2-sulfanylidene-quinazolin-4-olate Openeye Name: 7-[(2-chlorophenyl)methylcarbamoyl]-3-(2-fluorophenyl)-2-thioxo-quinazolin-4-olate CAS Name: 7-[[(2-chlorophenyl)methylamino]-oxomethyl]-3-(2-fluorophenyl)-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-[(2-chlorophenyl)methylcarbamoyl]-3-(2-fluorophenyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 7-[(2-chlorobenzyl)carbamoyl]-3-(2-fluorophenyl)-2-thioxo-quinazolin-4-olate Formula: C22H14ClFN3O2S- MolecularWeight: 438.881863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=CC3=NC(=S)N(C(=C3C=C2)[O-])C4=CC=CC=C4F)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=CC3=NC(=S)N(C(=C3C=C2)[O-])C4=CC=CC=C4F)Cl

InChI

InChI=1S/C22H15ClFN3O2S/c23-16-6-2-1-5-14(16)12-25-20(28)13-9-10-15-18(11-13)26-22(30)27(21(15)29)19-8-4-3-7-17(19)24/h1-11,29H,12H2,(H,25,28)/p-1