2-(1-adamantyl)-4-oxidanylidene-thiochromene-6-carbonitrile

Systemtic Name: 2-(1-adamantyl)-4-oxidanylidene-thiochromene-6-carbonitrile Openeye Name: 2-(1-adamantyl)-4-oxo-thiochromene-6-carbonitrile CAS Name: 2-(1-adamantyl)-4-oxo-1-benzothiopyran-6-carbonitrile IUPAC Name: 2-(1-adamantyl)-4-oxothiochromene-6-carbonitrile Traditional Name: 2-(1-adamantyl)-4-keto-thiochromene-6-carbonitrile Formula: C20H19NOS MolecularWeight: 321.43596

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=O)C5=C(S4)C=CC(=C5)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=O)C5=C(S4)C=CC(=C5)C#N

InChI

InChI=1S/C20H19NOS/c21-11-12-1-2-18-16(6-12)17(22)7-19(23-18)20-8-13-3-14(9-20)5-15(4-13)10-20/h1-2,6-7,13-15H,3-5,8-10H2