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

Systemtic Name: N-cyclopropyl-2-[5-(hydroxymethyl)-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-imidazol-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[5-(hydroxymethyl)-2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-imidazol-1-yl]acetamide CAS Name: N-cyclopropyl-2-[5-(hydroxymethyl)-2-[[2-(3-methylanilino)-2-oxoethyl]thio]-1-imidazolyl]acetamide IUPAC Name: N-cyclopropyl-2-[5-(hydroxymethyl)-2-[2-(3-methylanilino)-2-oxoethyl]sulfanylimidazol-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[2-[[2-keto-2-(m-toluidino)ethyl]thio]-5-methylol-imidazol-1-yl]acetamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NC=C(N2CC(=O)NC3CC3)CO

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NC=C(N2CC(=O)NC3CC3)CO

InChI

InChI=1S/C18H22N4O3S/c1-12-3-2-4-14(7-12)21-17(25)11-26-18-19-8-15(10-23)22(18)9-16(24)20-13-5-6-13/h2-4,7-8,13,23H,5-6,9-11H2,1H3,(H,20,24)(H,21,25)