6-chloranyl-7-methyl-4-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylsulfanylmethyl)chromen-2-one

Systemtic Name: 6-chloranyl-7-methyl-4-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylsulfanylmethyl)chromen-2-one Openeye Name: 6-chloro-7-methyl-4-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylsulfanylmethyl)chromen-2-one CAS Name: 6-chloro-7-methyl-4-[(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylthio)methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-methyl-4-(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylsulfanylmethyl)chromen-2-one Traditional Name: 6-chloro-7-methyl-4-[(3H-[1,2,4]triazolo[4,3-a]benzimidazol-1-ylthio)methyl]coumarin Formula: C19H13ClN4O2S MolecularWeight: 396.85012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NNC4=NC5=CC=CC=C5N43)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=NNC4=NC5=CC=CC=C5N43)Cl

InChI

InChI=1S/C19H13ClN4O2S/c1-10-6-16-12(8-13(10)20)11(7-17(25)26-16)9-27-19-23-22-18-21-14-4-2-3-5-15(14)24(18)19/h2-8H,9H2,1H3,(H,21,22)