2-(phenylcarbonyl)-1H-[1]benzothiolo[2,3-d]pyridazine-1-carbonitrile

Systemtic Name: 2-(phenylcarbonyl)-1H-[1]benzothiolo[2,3-d]pyridazine-1-carbonitrile Openeye Name: 2-benzoyl-1H-benzothiopheno[2,3-d]pyridazine-1-carbonitrile CAS Name: 2-benzoyl-1H-[1]benzothiolo[2,3-d]pyridazine-1-carbonitrile IUPAC Name: 2-benzoyl-1H-[1]benzothiolo[2,3-d]pyridazine-1-carbonitrile Traditional Name: 2-benzoyl-1H-benzothiopheno[2,3-d]pyridazine-1-carbonitrile Formula: C18H11N3OS MolecularWeight: 317.36444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N2C(C3=C(C=N2)SC4=CC=CC=C43)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N2C(C3=C(C=N2)SC4=CC=CC=C43)C#N

InChI

InChI=1S/C18H11N3OS/c19-10-14-17-13-8-4-5-9-15(13)23-16(17)11-20-21(14)18(22)12-6-2-1-3-7-12/h1-9,11,14H