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

Systemtic Name: N-methyl-2-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-N-methyl-2-(4-methyl-1-oxo-benzothiopheno[2,3-d]pyridazin-2-yl)butanamide CAS Name: N-methyl-2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-N-methyl-2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)butanamide Traditional Name: N-benzyl-2-(1-keto-4-methyl-benzothiopheno[2,3-d]pyridazin-2-yl)-N-methyl-butyramide Formula: C23H23N3O2S MolecularWeight: 405.51262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C)CC1=CC=CC=C1)N2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43

Isomeric SMILES

CCC(C(=O)N(C)CC1=CC=CC=C1)N2C(=O)C3=C(C(=N2)C)SC4=CC=CC=C43

InChI

InChI=1S/C23H23N3O2S/c1-4-18(22(27)25(3)14-16-10-6-5-7-11-16)26-23(28)20-17-12-8-9-13-19(17)29-21(20)15(2)24-26/h5-13,18H,4,14H2,1-3H3