4-chloranyl-3-nitro-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide Openeye Name: 4-chloro-3-nitro-N-(2-thiazol-4-ylethyl)benzamide CAS Name: 4-chloro-3-nitro-N-[2-(4-thiazolyl)ethyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide Traditional Name: 4-chloro-3-nitro-N-(2-thiazol-4-ylethyl)benzamide Formula: C12H10ClN3O3S MolecularWeight: 311.7441

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NCCC2=CSC=N2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NCCC2=CSC=N2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H10ClN3O3S/c13-10-2-1-8(5-11(10)16(18)19)12(17)14-4-3-9-6-20-7-15-9/h1-2,5-7H,3-4H2,(H,14,17)