N-(1-butanoyl-5-nitro-2,1-benzothiazol-3-ylidene)butanamide

Systemtic Name: N-(1-butanoyl-5-nitro-2,1-benzothiazol-3-ylidene)butanamide Openeye Name: N-(1-butanoyl-5-nitro-2,1-benzothiazol-3-ylidene)butanamide CAS Name: N-[5-nitro-1-(1-oxobutyl)-2,1-benzothiazol-3-ylidene]butanamide IUPAC Name: N-(1-butanoyl-5-nitro-2,1-benzothiazol-3-ylidene)butanamide Traditional Name: N-(1-butyryl-5-nitro-2,1-benzothiazol-3-ylidene)butyramide Formula: C15H17N3O4S MolecularWeight: 335.37818

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N=C1C2=C(C=CC(=C2)[N+](=O)[O-])N(S1)C(=O)CCC

Isomeric SMILES

CCCC(=O)N=C1C2=C(C=CC(=C2)[N+](=O)[O-])N(S1)C(=O)CCC

InChI

InChI=1S/C15H17N3O4S/c1-3-5-13(19)16-15-11-9-10(18(21)22)7-8-12(11)17(23-15)14(20)6-4-2/h7-9H,3-6H2,1-2H3