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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)C(C)C(=O)NC4CCCCCC4

Isomeric SMILES

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)C(C)C(=O)NC4CCCCCC4

InChI

InChI=1S/C21H25N3O2S/c1-13-19-18(16-11-7-8-12-17(16)27-19)21(26)24(23-13)14(2)20(25)22-15-9-5-3-4-6-10-15/h7-8,11-12,14-15H,3-6,9-10H2,1-2H3,(H,22,25)