N-[4-[3-[(5-bromanyl-3-methyl-pyridin-2-yl)amino]propylamino]-1-oxidanylidene-1,2,5-thiadiazol-3-yl]pyridine-3-carboxamide

Systemtic Name: N-[4-[3-[(5-bromanyl-3-methyl-pyridin-2-yl)amino]propylamino]-1-oxidanylidene-1,2,5-thiadiazol-3-yl]pyridine-3-carboxamide Openeye Name: N-[4-[3-[(5-bromo-3-methyl-2-pyridyl)amino]propylamino]-1-oxo-1,2,5-thiadiazol-3-yl]pyridine-3-carboxamide CAS Name: N-[4-[3-[(5-bromo-3-methyl-2-pyridinyl)amino]propylamino]-1-oxo-1,2,5-thiadiazol-3-yl]-3-pyridinecarboxamide IUPAC Name: N-[4-[3-[(5-bromo-3-methylpyridin-2-yl)amino]propylamino]-1-oxo-1,2,5-thiadiazol-3-yl]pyridine-3-carboxamide Traditional Name: N-[4-[3-[(5-bromo-3-methyl-2-pyridyl)amino]propylamino]-1-keto-1,2,5-thiadiazol-3-yl]nicotinamide Formula: C17H18BrN7O2S MolecularWeight: 464.33952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1NCCCNC2=NS(=O)N=C2NC(=O)C3=CN=CC=C3)Br

Isomeric SMILES

CC1=CC(=CN=C1NCCCNC2=NS(=O)N=C2NC(=O)C3=CN=CC=C3)Br

InChI

InChI=1S/C17H18BrN7O2S/c1-11-8-13(18)10-22-14(11)20-6-3-7-21-15-16(25-28(27)24-15)23-17(26)12-4-2-5-19-9-12/h2,4-5,8-10H,3,6-7H2,1H3,(H,20,22)(H,21,24)(H,23,25,26)