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

Systemtic Name: 7-bromanyl-1-(ethylsulfonylmethyl)-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-bromo-1-(ethylsulfonylmethyl)-5-(2-pyridyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-bromo-1-(ethylsulfonylmethyl)-5-(2-pyridinyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-bromo-1-(ethylsulfonylmethyl)-5-pyridin-2-yl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-bromo-1-(esylmethyl)-5-(2-pyridyl)-3H-1,4-benzodiazepin-2-one Formula: C17H16BrN3O3S MolecularWeight: 422.29624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3O3S/c1-2-25(23,24)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