4-chloranyl-N-[5-(2-fluorophenyl)-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl]benzamide

Systemtic Name: 4-chloranyl-N-[5-(2-fluorophenyl)-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl]benzamide Openeye Name: 4-chloro-N-[5-(2-fluorophenyl)-2-thioxo-1,3-dihydro-1,4-benzodiazepin-3-yl]benzamide CAS Name: 4-chloro-N-[5-(2-fluorophenyl)-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl]benzamide IUPAC Name: 4-chloro-N-[5-(2-fluorophenyl)-2-sulfanylidene-1,3-dihydro-1,4-benzodiazepin-3-yl]benzamide Traditional Name: 4-chloro-N-[5-(2-fluorophenyl)-2-thioxo-1,3-dihydro-1,4-benzodiazepin-3-yl]benzamide Formula: C22H15ClFN3OS MolecularWeight: 423.890403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(C(=S)N2)NC(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(C(=S)N2)NC(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4F

InChI

InChI=1S/C22H15ClFN3OS/c23-14-11-9-13(10-12-14)21(28)27-20-22(29)25-18-8-4-2-6-16(18)19(26-20)15-5-1-3-7-17(15)24/h1-12,20H,(H,25,29)(H,27,28)