2-[5-(hydroxymethyl)-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-imidazol-1-yl]ethanamide

Systemtic Name: 2-[5-(hydroxymethyl)-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-imidazol-1-yl]ethanamide Openeye Name: 2-[5-(hydroxymethyl)-2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-imidazol-1-yl]acetamide CAS Name: 2-[5-(hydroxymethyl)-2-[[2-(3-methylanilino)-2-oxoethyl]thio]-1-imidazolyl]acetamide IUPAC Name: 2-[5-(hydroxymethyl)-2-[2-(3-methylanilino)-2-oxoethyl]sulfanylimidazol-1-yl]acetamide Traditional Name: 2-[2-[[2-keto-2-(m-toluidino)ethyl]thio]-5-methylol-imidazol-1-yl]acetamide Formula: C15H18N4O3S MolecularWeight: 334.39342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NC=C(N2CC(=O)N)CO

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NC=C(N2CC(=O)N)CO

InChI

InChI=1S/C15H18N4O3S/c1-10-3-2-4-11(5-10)18-14(22)9-23-15-17-6-12(8-20)19(15)7-13(16)21/h2-6,20H,7-9H2,1H3,(H2,16,21)(H,18,22)