3-[[5,6-bis(chloranyl)-1H-benzimidazol-2-yl]sulfanylmethyl]-8-methoxy-chromen-2-one

Systemtic Name: 3-[[5,6-bis(chloranyl)-1H-benzimidazol-2-yl]sulfanylmethyl]-8-methoxy-chromen-2-one Openeye Name: 3-[(5,6-dichloro-1H-benzimidazol-2-yl)sulfanylmethyl]-8-methoxy-chromen-2-one CAS Name: 3-[[(5,6-dichloro-1H-benzimidazol-2-yl)thio]methyl]-8-methoxy-1-benzopyran-2-one IUPAC Name: 3-[(5,6-dichloro-1H-benzimidazol-2-yl)sulfanylmethyl]-8-methoxychromen-2-one Traditional Name: 3-[[(5,6-dichloro-1H-benzimidazol-2-yl)thio]methyl]-8-methoxy-coumarin Formula: C18H12Cl2N2O3S MolecularWeight: 407.27048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)CSC3=NC4=CC(=C(C=C4N3)Cl)Cl

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)CSC3=NC4=CC(=C(C=C4N3)Cl)Cl

InChI

InChI=1S/C18H12Cl2N2O3S/c1-24-15-4-2-3-9-5-10(17(23)25-16(9)15)8-26-18-21-13-6-11(19)12(20)7-14(13)22-18/h2-7H,8H2,1H3,(H,21,22)