4-[2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanylethanoylamino]-N-methyl-benzamide

Systemtic Name: 4-[2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanylethanoylamino]-N-methyl-benzamide Openeye Name: 4-[[2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]amino]-N-methyl-benzamide CAS Name: 4-[[2-[[1-(3,4-dimethylphenyl)-2-imidazolyl]thio]-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 4-[[2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanylacetyl]amino]-N-methylbenzamide Traditional Name: 4-[[2-[[1-(3,4-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=C(C=C(C=C1)N2C=CN=C2SCC(=O)NC3=CC=C(C=C3)C(=O)NC)C

Isomeric SMILES

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

InChI

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