7-bromanyl-4-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 7-bromanyl-4-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]chromen-2-one Openeye Name: 7-bromo-4-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-bromo-4-[[(6-methyl-1H-benzimidazol-2-yl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-bromo-4-[[(6-methyl-1H-benzimidazol-2-yl)thio]methyl]coumarin Formula: C18H13BrN2O2S MolecularWeight: 401.27702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C18H13BrN2O2S/c1-10-2-5-14-15(6-10)21-18(20-14)24-9-11-7-17(22)23-16-8-12(19)3-4-13(11)16/h2-8H,9H2,1H3,(H,20,21)