4-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one

Systemtic Name: 4-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one Openeye Name: 4-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-7-methyl-chromen-2-one CAS Name: 4-[[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylmethyl]-7-methylchromen-2-one Traditional Name: 4-[[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]methyl]-7-methyl-coumarin Formula: C21H20N2O3S MolecularWeight: 380.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4N3CCOC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4N3CCOC

InChI

InChI=1S/C21H20N2O3S/c1-14-7-8-16-15(12-20(24)26-19(16)11-14)13-27-21-22-17-5-3-4-6-18(17)23(21)9-10-25-2/h3-8,11-12H,9-10,13H2,1-2H3