3-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl]chromen-2-one

Systemtic Name: 3-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl]chromen-2-one Openeye Name: 3-[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]chromen-2-one CAS Name: 3-[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]chromen-2-one Traditional Name: 3-[2-(1H-benzimidazol-2-ylthio)acetyl]coumarin Formula: C18H12N2O3S MolecularWeight: 336.36448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H12N2O3S/c21-15(10-24-18-19-13-6-2-3-7-14(13)20-18)12-9-11-5-1-4-8-16(11)23-17(12)22/h1-9H,10H2,(H,19,20)