N-(2-methyl-1-thiophen-2-yl-propyl)-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-(2-methyl-1-thiophen-2-yl-propyl)-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-[2-methyl-1-(2-thienyl)propyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-(2-methyl-1-thiophen-2-ylpropyl)-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-(2-methyl-1-thiophen-2-ylpropyl)-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: 6-keto-N-[2-methyl-1-(2-thienyl)propyl]-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C1=CC=CS1)NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3S/c1-15(2)20(18-9-6-14-28-18)22-21(26)17-10-11-19(25)24(23-17)12-13-27-16-7-4-3-5-8-16/h3-11,14-15,20H,12-13H2,1-2H3,(H,22,26)