7-chloranyl-5-(2-fluorophenyl)-1-(2-methylsulfanylethyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-(2-fluorophenyl)-1-(2-methylsulfanylethyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-5-(2-fluorophenyl)-1-(2-methylsulfanylethyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-(2-fluorophenyl)-1-[2-(methylthio)ethyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-5-(2-fluorophenyl)-1-(2-methylsulfanylethyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-5-(2-fluorophenyl)-1-[2-(methylthio)ethyl]-3H-1,4-benzodiazepin-2-one Formula: C18H16ClFN2OS MolecularWeight: 362.848843

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Descriptors Computed from Structure

Canonical SMILES:

CSCCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F

Isomeric SMILES

CSCCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F

InChI

InChI=1S/C18H16ClFN2OS/c1-24-9-8-22-16-7-6-12(19)10-14(16)18(21-11-17(22)23)13-4-2-3-5-15(13)20/h2-7,10H,8-9,11H2,1H3