3-(3-cyclohexyl-2-sulfanylidene-1H-imidazol-5-yl)chromen-2-one

Systemtic Name: 3-(3-cyclohexyl-2-sulfanylidene-1H-imidazol-5-yl)chromen-2-one Openeye Name: 3-(3-cyclohexyl-2-thioxo-1H-imidazol-5-yl)chromen-2-one CAS Name: 3-(3-cyclohexyl-2-sulfanylidene-1H-imidazol-5-yl)-1-benzopyran-2-one IUPAC Name: 3-(3-cyclohexyl-2-sulfanylidene-1H-imidazol-5-yl)chromen-2-one Traditional Name: 3-(1-cyclohexyl-2-thioxo-4-imidazolin-4-yl)coumarin Formula: C18H18N2O2S MolecularWeight: 326.41272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C=C(NC2=S)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1CCC(CC1)N2C=C(NC2=S)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C18H18N2O2S/c21-17-14(10-12-6-4-5-9-16(12)22-17)15-11-20(18(23)19-15)13-7-2-1-3-8-13/h4-6,9-11,13H,1-3,7-8H2,(H,19,23)