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

Systemtic Name: 2-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-(3-piperidin-1-ylpropyl)propanamide Openeye Name: 2-(4-methyl-1-oxo-benzothiopheno[2,3-d]pyridazin-2-yl)-N-[3-(1-piperidyl)propyl]propanamide CAS Name: 2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-[3-(1-piperidinyl)propyl]propanamide IUPAC Name: 2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-(3-piperidin-1-ylpropyl)propanamide Traditional Name: 2-(1-keto-4-methyl-benzothiopheno[2,3-d]pyridazin-2-yl)-N-(3-piperidinopropyl)propionamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)C(C)C(=O)NCCCN4CCCCC4

Isomeric SMILES

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)C(C)C(=O)NCCCN4CCCCC4

InChI

InChI=1S/C22H28N4O2S/c1-15-20-19(17-9-4-5-10-18(17)29-20)22(28)26(24-15)16(2)21(27)23-11-8-14-25-12-6-3-7-13-25/h4-5,9-10,16H,3,6-8,11-14H2,1-2H3,(H,23,27)