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

Systemtic Name: 7-chloranyl-5-phenyl-1-(2-propylsulfonylethyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-5-phenyl-1-(2-propylsulfonylethyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-phenyl-1-(2-propylsulfonylethyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-5-phenyl-1-(2-propylsulfonylethyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-5-phenyl-1-(2-propylsulfonylethyl)-3H-1,4-benzodiazepin-2-one Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CCCS(=O)(=O)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H21ClN2O3S/c1-2-11-27(25,26)12-10-23-18-9-8-16(21)13-17(18)20(22-14-19(23)24)15-6-4-3-5-7-15/h3-9,13H,2,10-12,14H2,1H3