N-[(2-methoxyphenyl)methyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-[(2-methoxyphenyl)methyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-[(2-methoxyphenyl)methyl]-4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]-N-o-anisyl-benzamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3OC

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3OC

InChI

InChI=1S/C21H22N4O3S/c1-25-12-11-22-21(25)29-14-19(26)24-17-9-7-15(8-10-17)20(27)23-13-16-5-3-4-6-18(16)28-2/h3-12H,13-14H2,1-2H3,(H,23,27)(H,24,26)