4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-3-methoxy-benzaldehyde

Systemtic Name: 4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-3-methoxy-benzaldehyde Openeye Name: 4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-3-methoxy-benzaldehyde CAS Name: 4-[3-(1H-benzimidazol-2-ylthio)propoxy]-3-methoxybenzaldehyde IUPAC Name: 4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]-3-methoxybenzaldehyde Traditional Name: 4-[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=C(C=CC(=C1)C=O)OCCCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

COC1=C(C=CC(=C1)C=O)OCCCSC2=NC3=CC=CC=C3N2

InChI

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