2-[1-(1H-indazol-5-yl)-3-oxidanylidene-4,5,6,6a-tetrahydro-3aH-pentalen-2-yl]thiophene-3-carbonitrile

Systemtic Name: 2-[1-(1H-indazol-5-yl)-3-oxidanylidene-4,5,6,6a-tetrahydro-3aH-pentalen-2-yl]thiophene-3-carbonitrile Openeye Name: 2-[1-(1H-indazol-5-yl)-3-oxo-4,5,6,6a-tetrahydro-3aH-pentalen-2-yl]thiophene-3-carbonitrile CAS Name: 2-[1-(1H-indazol-5-yl)-3-oxo-4,5,6,6a-tetrahydro-3aH-pentalen-2-yl]-3-thiophenecarbonitrile IUPAC Name: 2-[1-(1H-indazol-5-yl)-3-oxo-4,5,6,6a-tetrahydro-3aH-pentalen-2-yl]thiophene-3-carbonitrile Traditional Name: 2-[1-(1H-indazol-5-yl)-3-keto-4,5,6,6a-tetrahydro-3aH-pentalen-2-yl]thiophene-3-carbonitrile Formula: C20H15N3OS MolecularWeight: 345.4176

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C1)C(=O)C(=C2C3=CC4=C(C=C3)NN=C4)C5=C(C=CS5)C#N

Isomeric SMILES

C1CC2C(C1)C(=O)C(=C2C3=CC4=C(C=C3)NN=C4)C5=C(C=CS5)C#N

InChI

InChI=1S/C20H15N3OS/c21-9-12-6-7-25-20(12)18-17(14-2-1-3-15(14)19(18)24)11-4-5-16-13(8-11)10-22-23-16/h4-8,10,14-15H,1-3H2,(H,22,23)