3-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylethanoylamino]-N-methyl-benzamide

Systemtic Name: 3-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylethanoylamino]-N-methyl-benzamide Openeye Name: 3-[[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]amino]-N-methyl-benzamide CAS Name: 3-[[2-[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 3-[[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]amino]-N-methylbenzamide Traditional Name: 3-[[2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]acetyl]amino]-N-methyl-benzamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)NC3=CC=CC(=C3)C(=O)NC)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2SCC(=O)NC3=CC=CC(=C3)C(=O)NC)C

InChI

InChI=1S/C21H22N4O2S/c1-14-9-15(2)11-18(10-14)25-8-7-23-21(25)28-13-19(26)24-17-6-4-5-16(12-17)20(27)22-3/h4-12H,13H2,1-3H3,(H,22,27)(H,24,26)