4-chloranyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-N-ethyl-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-N-ethyl-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]-N-ethyl-3-nitro-benzamide CAS Name: 4-chloro-N-[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]-N-ethyl-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-N-ethyl-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-keto-ethyl]-N-ethyl-3-nitro-benzamide Formula: C16H17ClN4O4S MolecularWeight: 396.84858

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=NC(=C(S1)C)C)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC(=O)NC1=NC(=C(S1)C)C)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN4O4S/c1-4-20(8-14(22)19-16-18-9(2)10(3)26-16)15(23)11-5-6-12(17)13(7-11)21(24)25/h5-7H,4,8H2,1-3H3,(H,18,19,22)