2-[1-cyclopentyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[1-cyclopentyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[1-cyclopentyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(3-nitrophenyl)acetamide CAS Name: 2-[[1-cyclopentyl-5-(hydroxymethyl)-2-imidazolyl]thio]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[1-cyclopentyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(3-nitrophenyl)acetamide Traditional Name: 2-[(1-cyclopentyl-5-methylol-imidazol-2-yl)thio]-N-(3-nitrophenyl)acetamide Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CN=C2SCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])CO

Isomeric SMILES

C1CCC(C1)N2C(=CN=C2SCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])CO

InChI

InChI=1S/C17H20N4O4S/c22-10-15-9-18-17(20(15)13-5-1-2-6-13)26-11-16(23)19-12-4-3-7-14(8-12)21(24)25/h3-4,7-9,13,22H,1-2,5-6,10-11H2,(H,19,23)