N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-(4-nitropyrazol-1-yl)butyramide Formula: C15H15N5O3S MolecularWeight: 345.3763

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)C)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)C)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C15H15N5O3S/c1-3-12(19-8-10(7-16-19)20(22)23)14(21)18-15-17-11-5-4-9(2)6-13(11)24-15/h4-8,12H,3H2,1-2H3,(H,17,18,21)