4-(1H-benzimidazol-2-ylsulfanylmethyl)-7-methyl-chromen-2-one

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-7-methyl-chromen-2-one Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-7-methyl-chromen-2-one CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-7-methylchromen-2-one Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-7-methyl-coumarin Formula: C18H14N2O2S MolecularWeight: 322.38096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H14N2O2S/c1-11-6-7-13-12(9-17(21)22-16(13)8-11)10-23-18-19-14-4-2-3-5-15(14)20-18/h2-9H,10H2,1H3,(H,19,20)