4-(6-acetamidopyridazin-3-yl)sulfanyl-N-(5-nitro-1,3-thiazol-2-yl)butanamide

Systemtic Name: 4-(6-acetamidopyridazin-3-yl)sulfanyl-N-(5-nitro-1,3-thiazol-2-yl)butanamide Openeye Name: 4-(6-acetamidopyridazin-3-yl)sulfanyl-N-(5-nitrothiazol-2-yl)butanamide CAS Name: 4-[(6-acetamido-3-pyridazinyl)thio]-N-(5-nitro-2-thiazolyl)butanamide IUPAC Name: 4-(6-acetamidopyridazin-3-yl)sulfanyl-N-(5-nitro-1,3-thiazol-2-yl)butanamide Traditional Name: 4-[(6-acetamidopyridazin-3-yl)thio]-N-(5-nitrothiazol-2-yl)butyramide Formula: C13H14N6O4S2 MolecularWeight: 382.41806

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN=C(C=C1)SCCCC(=O)NC2=NC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=NN=C(C=C1)SCCCC(=O)NC2=NC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N6O4S2/c1-8(20)15-9-4-5-11(18-17-9)24-6-2-3-10(21)16-13-14-7-12(25-13)19(22)23/h4-5,7H,2-3,6H2,1H3,(H,14,16,21)(H,15,17,20)