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

Systemtic Name: 7-chloranyl-1-(3-methylsulfonylpropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-(3-methylsulfonylpropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-(3-methylsulfonylpropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-(3-methylsulfonylpropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-1-(3-mesylpropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C19H19ClN2O3S MolecularWeight: 390.88376

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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=C3

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClN2O3S/c1-26(24,25)11-5-10-22-17-9-8-15(20)12-16(17)19(21-13-18(22)23)14-6-3-2-4-7-14/h2-4,6-9,12H,5,10-11,13H2,1H3