N-[4-(3-azanyl-5-bromanyl-pyridin-2-yl)butyl]-4-methoxy-1-oxidanylidene-1,2,5-thiadiazol-3-amine

Systemtic Name: N-[4-(3-azanyl-5-bromanyl-pyridin-2-yl)butyl]-4-methoxy-1-oxidanylidene-1,2,5-thiadiazol-3-amine Openeye Name: N-[4-(3-amino-5-bromo-2-pyridyl)butyl]-4-methoxy-1-oxo-1,2,5-thiadiazol-3-amine CAS Name: N-[4-(3-amino-5-bromo-2-pyridinyl)butyl]-4-methoxy-1-oxo-1,2,5-thiadiazol-3-amine IUPAC Name: N-[4-(3-amino-5-bromopyridin-2-yl)butyl]-4-methoxy-1-oxo-1,2,5-thiadiazol-3-amine Traditional Name: 4-(3-amino-5-bromo-2-pyridyl)butyl-(1-keto-4-methoxy-1,2,5-thiadiazol-3-yl)amine Formula: C12H16BrN5O2S MolecularWeight: 374.25674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NS(=O)N=C1NCCCCC2=NC=C(C=C2N)Br

Isomeric SMILES

COC1=NS(=O)N=C1NCCCCC2=NC=C(C=C2N)Br

InChI

InChI=1S/C12H16BrN5O2S/c1-20-12-11(17-21(19)18-12)15-5-3-2-4-10-9(14)6-8(13)7-16-10/h6-7H,2-5,14H2,1H3,(H,15,17)