2-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-3-methoxy-benzaldehyde

Systemtic Name: 2-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-3-methoxy-benzaldehyde Openeye Name: 2-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-3-methoxy-benzaldehyde CAS Name: 2-[3-(1H-benzimidazol-2-ylthio)propoxy]-3-methoxybenzaldehyde IUPAC Name: 2-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-3-methoxybenzaldehyde Traditional Name: 2-[3-(1H-benzimidazol-2-ylthio)propoxy]-3-methoxy-benzaldehyde Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCCCSC2=NC3=CC=CC=C3N2)C=O

Isomeric SMILES

COC1=CC=CC(=C1OCCCSC2=NC3=CC=CC=C3N2)C=O

InChI

InChI=1S/C18H18N2O3S/c1-22-16-9-4-6-13(12-21)17(16)23-10-5-11-24-18-19-14-7-2-3-8-15(14)20-18/h2-4,6-9,12H,5,10-11H2,1H3,(H,19,20)