2-[5-(hydroxymethyl)-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-imidazol-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[5-(hydroxymethyl)-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-imidazol-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[2-(2-anilino-2-oxo-ethyl)sulfanyl-5-(hydroxymethyl)imidazol-1-yl]-N-benzyl-acetamide CAS Name: 2-[2-[(2-anilino-2-oxoethyl)thio]-5-(hydroxymethyl)-1-imidazolyl]-N-(phenylmethyl)acetamide IUPAC Name: 2-[2-(2-anilino-2-oxoethyl)sulfanyl-5-(hydroxymethyl)imidazol-1-yl]-N-benzylacetamide Traditional Name: 2-[2-[(2-anilino-2-keto-ethyl)thio]-5-methylol-imidazol-1-yl]-N-benzyl-acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CN2C(=CN=C2SCC(=O)NC3=CC=CC=C3)CO

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CN2C(=CN=C2SCC(=O)NC3=CC=CC=C3)CO

InChI

InChI=1S/C21H22N4O3S/c26-14-18-12-23-21(29-15-20(28)24-17-9-5-2-6-10-17)25(18)13-19(27)22-11-16-7-3-1-4-8-16/h1-10,12,26H,11,13-15H2,(H,22,27)(H,24,28)