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

Systemtic Name: N-butan-2-yl-4-chloranyl-3-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Openeye Name: 4-chloro-3-nitro-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-4-chloro-3-nitro-N-[2-oxo-2-(2-thiazolylamino)ethyl]benzamide IUPAC Name: N-butan-2-yl-4-chloro-3-nitro-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Traditional Name: 4-chloro-N-[2-keto-2-(thiazol-2-ylamino)ethyl]-3-nitro-N-sec-butyl-benzamide Formula: C16H17ClN4O4S MolecularWeight: 396.84858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClN4O4S/c1-3-10(2)20(9-14(22)19-16-18-6-7-26-16)15(23)11-4-5-12(17)13(8-11)21(24)25/h4-8,10H,3,9H2,1-2H3,(H,18,19,22)