3-[1-(4-iodophenyl)-2-propan-2-ylsulfanyl-imidazol-4-yl]chromen-2-one

Systemtic Name: 3-[1-(4-iodophenyl)-2-propan-2-ylsulfanyl-imidazol-4-yl]chromen-2-one Openeye Name: 3-[1-(4-iodophenyl)-2-isopropylsulfanyl-imidazol-4-yl]chromen-2-one CAS Name: 3-[1-(4-iodophenyl)-2-(propan-2-ylthio)-4-imidazolyl]-1-benzopyran-2-one IUPAC Name: 3-[1-(4-iodophenyl)-2-propan-2-ylsulfanylimidazol-4-yl]chromen-2-one Traditional Name: 3-[1-(4-iodophenyl)-2-(isopropylthio)imidazol-4-yl]coumarin Formula: C21H17IN2O2S MolecularWeight: 488.34135

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC(=CN1C2=CC=C(C=C2)I)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC(C)SC1=NC(=CN1C2=CC=C(C=C2)I)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H17IN2O2S/c1-13(2)27-21-23-18(12-24(21)16-9-7-15(22)8-10-16)17-11-14-5-3-4-6-19(14)26-20(17)25/h3-13H,1-2H3