N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-(2-methoxyethyl)-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-(2-methoxyethyl)-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-(2-methoxyethyl)-6-oxo-pyridazine-3-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-(2-methoxyethyl)-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-6-keto-1-(2-methoxyethyl)pyridazine-3-carboxamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

COCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N4O3S/c1-29-13-12-26-21(27)11-10-18(25-26)22(28)23-16-8-6-15(7-9-16)14-20-24-17-4-2-3-5-19(17)30-20/h2-11H,12-14H2,1H3,(H,23,28)