N-methyl-3-[2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]ethanoylamino]benzamide

Systemtic Name: N-methyl-3-[2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: 3-[[2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]-N-methyl-benzamide CAS Name: N-methyl-3-[[2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 3-[[2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]-N-methylbenzamide Traditional Name: 3-[[2-[(4-benzyl-5-methyl-1H-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(N=C(N1)SCC(=O)NC2=CC=CC(=C2)C(=O)NC)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(N1)SCC(=O)NC2=CC=CC(=C2)C(=O)NC)CC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2S/c1-14-18(11-15-7-4-3-5-8-15)25-21(23-14)28-13-19(26)24-17-10-6-9-16(12-17)20(27)22-2/h3-10,12H,11,13H2,1-2H3,(H,22,27)(H,23,25)(H,24,26)