4-[7-bromanyl-2-methyl-1-(3-methylsulfanylpropyl)indol-3-yl]-2,3-bis(chloranyl)benzaldehyde

Systemtic Name: 4-[7-bromanyl-2-methyl-1-(3-methylsulfanylpropyl)indol-3-yl]-2,3-bis(chloranyl)benzaldehyde Openeye Name: 4-[7-bromo-2-methyl-1-(3-methylsulfanylpropyl)indol-3-yl]-2,3-dichloro-benzaldehyde CAS Name: 4-[7-bromo-2-methyl-1-[3-(methylthio)propyl]-3-indolyl]-2,3-dichlorobenzaldehyde IUPAC Name: 4-[7-bromo-2-methyl-1-(3-methylsulfanylpropyl)indol-3-yl]-2,3-dichlorobenzaldehyde Traditional Name: 4-[7-bromo-2-methyl-1-[3-(methylthio)propyl]indol-3-yl]-2,3-dichloro-benzaldehyde Formula: C20H18BrCl2NOS MolecularWeight: 471.23802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CCCSC)C(=CC=C2)Br)C3=C(C(=C(C=C3)C=O)Cl)Cl

Isomeric SMILES

CC1=C(C2=C(N1CCCSC)C(=CC=C2)Br)C3=C(C(=C(C=C3)C=O)Cl)Cl

InChI

InChI=1S/C20H18BrCl2NOS/c1-12-17(14-8-7-13(11-25)18(22)19(14)23)15-5-3-6-16(21)20(15)24(12)9-4-10-26-2/h3,5-8,11H,4,9-10H2,1-2H3