1-methyl-N-[4-[4-(3-methylbutanoylamino)phenyl]-1,3-thiazol-2-yl]-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 1-methyl-N-[4-[4-(3-methylbutanoylamino)phenyl]-1,3-thiazol-2-yl]-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-methyl-N-[4-[4-(3-methylbutanoylamino)phenyl]thiazol-2-yl]-6-oxo-pyridazine-3-carboxamide CAS Name: 1-methyl-N-[4-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-2-thiazolyl]-6-oxo-3-pyridazinecarboxamide IUPAC Name: 1-methyl-N-[4-[4-(3-methylbutanoylamino)phenyl]-1,3-thiazol-2-yl]-6-oxopyridazine-3-carboxamide Traditional Name: N-[4-[4-(isovalerylamino)phenyl]thiazol-2-yl]-6-keto-1-methyl-pyridazine-3-carboxamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(=O)C=C3)C

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(=O)C=C3)C

InChI

InChI=1S/C20H21N5O3S/c1-12(2)10-17(26)21-14-6-4-13(5-7-14)16-11-29-20(22-16)23-19(28)15-8-9-18(27)25(3)24-15/h4-9,11-12H,10H2,1-3H3,(H,21,26)(H,22,23,28)