3-[(3-pyrrol-1-ylphenyl)methylsulfanyl]benzaldehyde

Systemtic Name: 3-[(3-pyrrol-1-ylphenyl)methylsulfanyl]benzaldehyde Openeye Name: 3-[(3-pyrrol-1-ylphenyl)methylsulfanyl]benzaldehyde CAS Name: 3-[[3-(1-pyrrolyl)phenyl]methylthio]benzaldehyde IUPAC Name: 3-[(3-pyrrol-1-ylphenyl)methylsulfanyl]benzaldehyde Traditional Name: 3-[(3-pyrrol-1-ylbenzyl)thio]benzaldehyde Formula: C18H15NOS MolecularWeight: 293.3828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC=CC(=C2)CSC3=CC=CC(=C3)C=O

Isomeric SMILES

C1=CN(C=C1)C2=CC=CC(=C2)CSC3=CC=CC(=C3)C=O

InChI

InChI=1S/C18H15NOS/c20-13-15-5-4-8-18(12-15)21-14-16-6-3-7-17(11-16)19-9-1-2-10-19/h1-13H,14H2