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

Systemtic Name: 2-chloranyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)-4-nitro-benzamide Openeye Name: 2-chloro-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]-N-(3-methoxypropyl)-4-nitro-benzamide CAS Name: 2-chloro-N-[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]-N-(3-methoxypropyl)-4-nitrobenzamide IUPAC Name: 2-chloro-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-N-(3-methoxypropyl)-4-nitrobenzamide Traditional Name: 2-chloro-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-keto-ethyl]-N-(3-methoxypropyl)-4-nitro-benzamide Formula: C18H21ClN4O5S MolecularWeight: 440.90114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CN(CCCOC)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CN(CCCOC)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C18H21ClN4O5S/c1-11-12(2)29-18(20-11)21-16(24)10-22(7-4-8-28-3)17(25)14-6-5-13(23(26)27)9-15(14)19/h5-6,9H,4,7-8,10H2,1-3H3,(H,20,21,24)