5-chloranyl-N-(6-nitro-1,3-benzothiazol-2-yl)pentanamide

Systemtic Name: 5-chloranyl-N-(6-nitro-1,3-benzothiazol-2-yl)pentanamide Openeye Name: 5-chloro-N-(6-nitro-1,3-benzothiazol-2-yl)pentanamide CAS Name: 5-chloro-N-(6-nitro-1,3-benzothiazol-2-yl)pentanamide IUPAC Name: 5-chloro-N-(6-nitro-1,3-benzothiazol-2-yl)pentanamide Traditional Name: 5-chloro-N-(6-nitro-1,3-benzothiazol-2-yl)valeramide Formula: C12H12ClN3O3S MolecularWeight: 313.75998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)CCCCCl

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)CCCCCl

InChI

InChI=1S/C12H12ClN3O3S/c13-6-2-1-3-11(17)15-12-14-9-5-4-8(16(18)19)7-10(9)20-12/h4-5,7H,1-3,6H2,(H,14,15,17)