7-bromanyl-1-(2-methylsulfinylethyl)-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-bromanyl-1-(2-methylsulfinylethyl)-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-1-(2-methylsulfinylethyl)-5-(2-pyridyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-1-(2-methylsulfinylethyl)-5-(2-pyridinyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-1-(2-methylsulfinylethyl)-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-1-(2-methylsulfinylethyl)-5-(2-pyridyl)-3H-1,4-benzodiazepin-2-one Formula: C17H16BrN3O2S MolecularWeight: 406.29684

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=N3

Isomeric SMILES

CS(=O)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=N3

InChI

InChI=1S/C17H16BrN3O2S/c1-24(23)9-8-21-15-6-5-12(18)10-13(15)17(20-11-16(21)22)14-4-2-3-7-19-14/h2-7,10H,8-9,11H2,1H3