4-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-7-ethyl-chromen-2-one

Systemtic Name: 4-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-7-ethyl-chromen-2-one Openeye Name: 4-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-7-ethyl-chromen-2-one CAS Name: 4-[[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 4-[(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanylmethyl]-7-ethylchromen-2-one Traditional Name: 4-[[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]methyl]-7-ethyl-coumarin Formula: C22H26N2O2S MolecularWeight: 382.51904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC(=C(N3C4CCCC4)C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC(=C(N3C4CCCC4)C)C

InChI

InChI=1S/C22H26N2O2S/c1-4-16-9-10-19-17(12-21(25)26-20(19)11-16)13-27-22-23-14(2)15(3)24(22)18-7-5-6-8-18/h9-12,18H,4-8,13H2,1-3H3