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

Systemtic Name: 7-bromanyl-1-(methylsulfinylmethyl)-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-1-(methylsulfinylmethyl)-5-(2-pyridyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-1-(methylsulfinylmethyl)-5-(2-pyridinyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-1-(methylsulfinylmethyl)-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-1-(methylsulfinylmethyl)-5-(2-pyridyl)-3H-1,4-benzodiazepin-2-one Formula: C16H14BrN3O2S MolecularWeight: 392.27026

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=N3

Isomeric SMILES

CS(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=N3

InChI

InChI=1S/C16H14BrN3O2S/c1-23(22)10-20-14-6-5-11(17)8-12(14)16(19-9-15(20)21)13-4-2-3-7-18-13/h2-8H,9-10H2,1H3