2-[1-cyclopentyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide

Systemtic Name: 2-[1-cyclopentyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide Openeye Name: 2-[1-cyclopentyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: 2-[[1-cyclopentyl-5-(hydroxymethyl)-2-imidazolyl]thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide IUPAC Name: 2-[1-cyclopentyl-5-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: 2-[(1-cyclopentyl-5-methylol-imidazol-2-yl)thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CN=C2SCC(=O)NC3=CC4=C(C=C3)OCCO4)CO

Isomeric SMILES

C1CCC(C1)N2C(=CN=C2SCC(=O)NC3=CC4=C(C=C3)OCCO4)CO

InChI

InChI=1S/C19H23N3O4S/c23-11-15-10-20-19(22(15)14-3-1-2-4-14)27-12-18(24)21-13-5-6-16-17(9-13)26-8-7-25-16/h5-6,9-10,14,23H,1-4,7-8,11-12H2,(H,21,24)