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

Systemtic Name: 3-[1-(2,4-dichlorophenyl)-2-phenacylsulfanyl-imidazol-4-yl]chromen-2-one Openeye Name: 3-[1-(2,4-dichlorophenyl)-2-phenacylsulfanyl-imidazol-4-yl]chromen-2-one CAS Name: 3-[1-(2,4-dichlorophenyl)-2-(phenacylthio)-4-imidazolyl]-1-benzopyran-2-one IUPAC Name: 3-[1-(2,4-dichlorophenyl)-2-phenacylsulfanylimidazol-4-yl]chromen-2-one Traditional Name: 3-[1-(2,4-dichlorophenyl)-2-(phenacylthio)imidazol-4-yl]coumarin Formula: C26H16Cl2N2O3S MolecularWeight: 507.38784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC(=CN2C3=C(C=C(C=C3)Cl)Cl)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC(=CN2C3=C(C=C(C=C3)Cl)Cl)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C26H16Cl2N2O3S/c27-18-10-11-22(20(28)13-18)30-14-21(19-12-17-8-4-5-9-24(17)33-25(19)32)29-26(30)34-15-23(31)16-6-2-1-3-7-16/h1-14H,15H2