4-[(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one

Systemtic Name: 4-[(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Openeye Name: 4-[(1-amino-4-phenyl-imidazol-2-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one CAS Name: 4-[[(1-amino-4-phenyl-2-imidazolyl)thio]methyl]-7,8-dihydro-6H-cyclopenta[g][1]benzopyran-2-one IUPAC Name: 4-[(1-amino-4-phenylimidazol-2-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Traditional Name: 4-[[(1-amino-4-phenyl-imidazol-2-yl)thio]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Formula: C22H19N3O2S MolecularWeight: 389.47016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)CSC4=NC(=CN4N)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)CSC4=NC(=CN4N)C5=CC=CC=C5

InChI

InChI=1S/C22H19N3O2S/c23-25-12-19(14-5-2-1-3-6-14)24-22(25)28-13-17-11-21(26)27-20-10-16-8-4-7-15(16)9-18(17)20/h1-3,5-6,9-12H,4,7-8,13,23H2