N-hexyl-3-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide

Systemtic Name: N-hexyl-3-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Openeye Name: N-hexyl-3-nitro-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]benzamide CAS Name: N-hexyl-3-nitro-N-[2-oxo-2-(2-thiazolylamino)ethyl]benzamide IUPAC Name: N-hexyl-3-nitro-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Traditional Name: N-hexyl-N-[2-keto-2-(thiazol-2-ylamino)ethyl]-3-nitro-benzamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CC(=O)NC1=NC=CS1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCN(CC(=O)NC1=NC=CS1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O4S/c1-2-3-4-5-10-21(13-16(23)20-18-19-9-11-27-18)17(24)14-7-6-8-15(12-14)22(25)26/h6-9,11-12H,2-5,10,13H2,1H3,(H,19,20,23)