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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3O2S/c1-2-24(23)11-21-15-7-6-12(18)9-13(15)17(20-10-16(21)22)14-5-3-4-8-19-14/h3-9H,2,10-11H2,1H3