4-[(3-azanylpyridin-2-yl)sulfanylmethyl]-7-bromanyl-chromen-2-one

Systemtic Name: 4-[(3-azanylpyridin-2-yl)sulfanylmethyl]-7-bromanyl-chromen-2-one Openeye Name: 4-[(3-amino-2-pyridyl)sulfanylmethyl]-7-bromo-chromen-2-one CAS Name: 4-[[(3-amino-2-pyridinyl)thio]methyl]-7-bromo-1-benzopyran-2-one IUPAC Name: 4-[(3-aminopyridin-2-yl)sulfanylmethyl]-7-bromochromen-2-one Traditional Name: 4-[[(3-amino-2-pyridyl)thio]methyl]-7-bromo-coumarin Formula: C15H11BrN2O2S MolecularWeight: 363.22904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC2=CC(=O)OC3=C2C=CC(=C3)Br)N

Isomeric SMILES

C1=CC(=C(N=C1)SCC2=CC(=O)OC3=C2C=CC(=C3)Br)N

InChI

InChI=1S/C15H11BrN2O2S/c16-10-3-4-11-9(6-14(19)20-13(11)7-10)8-21-15-12(17)2-1-5-18-15/h1-7H,8,17H2