2-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(2-methoxy-5-nitro-phenyl)propanamide

Systemtic Name: 2-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(2-methoxy-5-nitro-phenyl)propanamide Openeye Name: 2-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(2-methoxy-5-nitro-phenyl)propanamide CAS Name: 2-[[1-(2,5-dimethylphenyl)-2-imidazolyl]thio]-N-(2-methoxy-5-nitrophenyl)propanamide IUPAC Name: 2-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(2-methoxy-5-nitrophenyl)propanamide Traditional Name: 2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]thio]-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=CN=C2SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=CN=C2SC(C)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H22N4O4S/c1-13-5-6-14(2)18(11-13)24-10-9-22-21(24)30-15(3)20(26)23-17-12-16(25(27)28)7-8-19(17)29-4/h5-12,15H,1-4H3,(H,23,26)