3-[1-(2,4-dichlorophenyl)-2-propylsulfanyl-imidazol-4-yl]chromen-2-one

Systemtic Name: 3-[1-(2,4-dichlorophenyl)-2-propylsulfanyl-imidazol-4-yl]chromen-2-one Openeye Name: 3-[1-(2,4-dichlorophenyl)-2-propylsulfanyl-imidazol-4-yl]chromen-2-one CAS Name: 3-[1-(2,4-dichlorophenyl)-2-(propylthio)-4-imidazolyl]-1-benzopyran-2-one IUPAC Name: 3-[1-(2,4-dichlorophenyl)-2-propylsulfanylimidazol-4-yl]chromen-2-one Traditional Name: 3-[1-(2,4-dichlorophenyl)-2-(propylthio)imidazol-4-yl]coumarin Formula: C21H16Cl2N2O2S MolecularWeight: 431.33494

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=CN1C2=C(C=C(C=C2)Cl)Cl)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CCCSC1=NC(=CN1C2=C(C=C(C=C2)Cl)Cl)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H16Cl2N2O2S/c1-2-9-28-21-24-17(12-25(21)18-8-7-14(22)11-16(18)23)15-10-13-5-3-4-6-19(13)27-20(15)26/h3-8,10-12H,2,9H2,1H3