6-tert-butyl-8-methyl-4-(methylsulfanylmethyl)azulene-1-carbaldehyde

Systemtic Name: 6-tert-butyl-8-methyl-4-(methylsulfanylmethyl)azulene-1-carbaldehyde Openeye Name: 6-tert-butyl-8-methyl-4-(methylsulfanylmethyl)azulene-1-carbaldehyde CAS Name: 6-tert-butyl-8-methyl-4-[(methylthio)methyl]-1-azulenecarboxaldehyde IUPAC Name: 6-tert-butyl-8-methyl-4-(methylsulfanylmethyl)azulene-1-carbaldehyde Traditional Name: 6-tert-butyl-8-methyl-4-[(methylthio)methyl]azulene-1-carbaldehyde Formula: C18H22OS MolecularWeight: 286.43168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C2C1=C(C=C2)C=O)CSC)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C2C1=C(C=C2)C=O)CSC)C(C)(C)C

InChI

InChI=1S/C18H22OS/c1-12-8-15(18(2,3)4)9-14(11-20-5)16-7-6-13(10-19)17(12)16/h6-10H,11H2,1-5H3