1-[4-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[4-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanoyl]piperidine-4-carboxamide Openeye Name: 1-[4-(4-methyl-1-oxo-benzothiopheno[2,3-d]pyridazin-2-yl)butanoyl]piperidine-4-carboxamide CAS Name: 1-[4-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)-1-oxobutyl]-4-piperidinecarboxamide IUPAC Name: 1-[4-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanoyl]piperidine-4-carboxamide Traditional Name: 1-[4-(1-keto-4-methyl-benzothiopheno[2,3-d]pyridazin-2-yl)butanoyl]isonipecotamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)CCCC(=O)N4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)CCCC(=O)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C21H24N4O3S/c1-13-19-18(15-5-2-3-6-16(15)29-19)21(28)25(23-13)10-4-7-17(26)24-11-8-14(9-12-24)20(22)27/h2-3,5-6,14H,4,7-12H2,1H3,(H2,22,27)