4,5-dimethoxy-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-2-nitro-benzamide

Systemtic Name: 4,5-dimethoxy-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-2-nitro-benzamide Openeye Name: 4,5-dimethoxy-N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-2-nitro-benzamide CAS Name: 4,5-dimethoxy-N-[2-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]-2-nitrobenzamide IUPAC Name: 4,5-dimethoxy-N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-2-nitrobenzamide Traditional Name: 4,5-dimethoxy-N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-2-nitro-benzamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CCNC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CCNC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C21H21N3O5S/c1-13-23-17(12-30-13)15-6-4-14(5-7-15)8-9-22-21(25)16-10-19(28-2)20(29-3)11-18(16)24(26)27/h4-7,10-12H,8-9H2,1-3H3,(H,22,25)