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

Systemtic Name: 7-chloranyl-5-(2-fluorophenyl)-1-(3-methylsulfonylpropyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-5-(2-fluorophenyl)-1-(3-methylsulfonylpropyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-(2-fluorophenyl)-1-(3-methylsulfonylpropyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-5-(2-fluorophenyl)-1-(3-methylsulfonylpropyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-5-(2-fluorophenyl)-1-(3-mesylpropyl)-3H-1,4-benzodiazepin-2-one Formula: C19H18ClFN2O3S MolecularWeight: 408.874223

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F

Isomeric SMILES

CS(=O)(=O)CCCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F

InChI

InChI=1S/C19H18ClFN2O3S/c1-27(25,26)10-4-9-23-17-8-7-13(20)11-15(17)19(22-12-18(23)24)14-5-2-3-6-16(14)21/h2-3,5-8,11H,4,9-10,12H2,1H3