N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(6-oxidanylidene-3-pyridin-4-yl-pyridazin-1-yl)butanamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(6-oxidanylidene-3-pyridin-4-yl-pyridazin-1-yl)butanamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-[6-oxo-3-(4-pyridyl)pyridazin-1-yl]butanamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(6-oxo-3-pyridin-4-yl-1-pyridazinyl)butanamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)butanamide Traditional Name: 4-[6-keto-3-(4-pyridyl)pyridazin-1-yl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butyramide Formula: C27H23N5O2S MolecularWeight: 481.56882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCCN4C(=O)C=CC(=N4)C5=CC=NC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCCN4C(=O)C=CC(=N4)C5=CC=NC=C5

InChI

InChI=1S/C27H23N5O2S/c1-18-4-9-23-24(17-18)35-27(30-23)20-5-7-21(8-6-20)29-25(33)3-2-16-32-26(34)11-10-22(31-32)19-12-14-28-15-13-19/h4-15,17H,2-3,16H2,1H3,(H,29,33)