N-benzo[e][1,3]benzothiazol-2-yl-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C24H18N4O3S MolecularWeight: 442.48972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCN2C(=O)C=CC(=N2)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)OCCN2C(=O)C=CC(=N2)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

InChI

InChI=1S/C24H18N4O3S/c29-21-13-11-19(27-28(21)14-15-31-17-7-2-1-3-8-17)23(30)26-24-25-22-18-9-5-4-6-16(18)10-12-20(22)32-24/h1-13H,14-15H2,(H,25,26,30)