6-(4-methoxyphenyl)sulfanylazulene-1-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)sulfanylazulene-1-carbonitrile Openeye Name: 6-(4-methoxyphenyl)sulfanylazulene-1-carbonitrile CAS Name: 6-[(4-methoxyphenyl)thio]-1-azulenecarbonitrile IUPAC Name: 6-(4-methoxyphenyl)sulfanylazulene-1-carbonitrile Traditional Name: 6-[(4-methoxyphenyl)thio]azulene-1-carbonitrile Formula: C18H13NOS MolecularWeight: 291.36692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2=CC=C3C=CC(=C3C=C2)C#N

Isomeric SMILES

COC1=CC=C(C=C1)SC2=CC=C3C=CC(=C3C=C2)C#N

InChI

InChI=1S/C18H13NOS/c1-20-15-5-8-17(9-6-15)21-16-7-4-13-2-3-14(12-19)18(13)11-10-16/h2-11H,1H3