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

Systemtic Name: 2-chloranyl-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-4-nitro-N-pentyl-benzamide Openeye Name: 2-chloro-N-[2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl]-4-nitro-N-pentyl-benzamide CAS Name: 2-chloro-N-[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl]-4-nitro-N-pentylbenzamide IUPAC Name: 2-chloro-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-4-nitro-N-pentylbenzamide Traditional Name: N-amyl-2-chloro-N-[2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl]-4-nitro-benzamide Formula: C18H21ClN4O4S MolecularWeight: 424.90174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN4O4S/c1-3-4-5-8-22(10-16(24)21-18-20-12(2)11-28-18)17(25)14-7-6-13(23(26)27)9-15(14)19/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,20,21,24)