ethyl 4-methyl-2-[[3-(2-methylpropyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[3-(2-methylpropyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(3-isobutyl-4-oxo-phthalazine-1-carbonyl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 4-methyl-2-[[[3-(2-methylpropyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[3-(2-methylpropyl)-4-oxophthalazine-1-carbonyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3-isobutyl-4-keto-phthalazine-1-carbonyl)amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C)C

InChI

InChI=1S/C20H22N4O4S/c1-5-28-19(27)16-12(4)21-20(29-16)22-17(25)15-13-8-6-7-9-14(13)18(26)24(23-15)10-11(2)3/h6-9,11H,5,10H2,1-4H3,(H,21,22,25)