N-(2-methyl-6-nitro-phenyl)-2-[1-(4-propan-2-ylphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-methyl-6-nitro-phenyl)-2-[1-(4-propan-2-ylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-(4-isopropylphenyl)imidazol-2-yl]sulfanyl-N-(2-methyl-6-nitro-phenyl)acetamide CAS Name: N-(2-methyl-6-nitrophenyl)-2-[[1-(4-propan-2-ylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(2-methyl-6-nitrophenyl)-2-[1-(4-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(2-methyl-6-nitro-phenyl)-2-[(1-p-cumenylimidazol-2-yl)thio]acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)CSC2=NC=CN2C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)CSC2=NC=CN2C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H22N4O3S/c1-14(2)16-7-9-17(10-8-16)24-12-11-22-21(24)29-13-19(26)23-20-15(3)5-4-6-18(20)25(27)28/h4-12,14H,13H2,1-3H3,(H,23,26)