6-chloranyl-4-[[4,5-dimethyl-1-(oxolan-2-ylmethyl)imidazol-2-yl]sulfanylmethyl]-7-ethyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-[[4,5-dimethyl-1-(oxolan-2-ylmethyl)imidazol-2-yl]sulfanylmethyl]-7-ethyl-chromen-2-one Openeye Name: 6-chloro-4-[[4,5-dimethyl-1-(tetrahydrofuran-2-ylmethyl)imidazol-2-yl]sulfanylmethyl]-7-ethyl-chromen-2-one CAS Name: 6-chloro-4-[[[4,5-dimethyl-1-(2-oxolanylmethyl)-2-imidazolyl]thio]methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[4,5-dimethyl-1-(oxolan-2-ylmethyl)imidazol-2-yl]sulfanylmethyl]-7-ethylchromen-2-one Traditional Name: 6-chloro-4-[[[4,5-dimethyl-1-(tetrahydrofurfuryl)imidazol-2-yl]thio]methyl]-7-ethyl-coumarin Formula: C22H25ClN2O3S MolecularWeight: 432.9635

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC(=C(N3CC4CCCO4)C)C)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NC(=C(N3CC4CCCO4)C)C)Cl

InChI

InChI=1S/C22H25ClN2O3S/c1-4-15-8-20-18(10-19(15)23)16(9-21(26)28-20)12-29-22-24-13(2)14(3)25(22)11-17-6-5-7-27-17/h8-10,17H,4-7,11-12H2,1-3H3