N-(4-methylcyclohexyl)-2-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)propanamide

Systemtic Name: N-(4-methylcyclohexyl)-2-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)propanamide Openeye Name: N-(4-methylcyclohexyl)-2-(4-methyl-1-oxo-benzothiopheno[2,3-d]pyridazin-2-yl)propanamide CAS Name: N-(4-methylcyclohexyl)-2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)propanamide IUPAC Name: N-(4-methylcyclohexyl)-2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)propanamide Traditional Name: 2-(1-keto-4-methyl-benzothiopheno[2,3-d]pyridazin-2-yl)-N-(4-methylcyclohexyl)propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)C(C)N2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43

Isomeric SMILES

CC1CCC(CC1)NC(=O)C(C)N2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43

InChI

InChI=1S/C21H25N3O2S/c1-12-8-10-15(11-9-12)22-20(25)14(3)24-21(26)18-16-6-4-5-7-17(16)27-19(18)13(2)23-24/h4-7,12,14-15H,8-11H2,1-3H3,(H,22,25)