N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[4-(4-ethylphenyl)thiazol-2-yl]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(4-ethylphenyl)-2-thiazolyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[4-(4-ethylphenyl)thiazol-2-yl]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

InChI

InChI=1S/C23H22N4O2S/c1-4-15-9-11-16(12-10-15)19-13-30-23(24-19)25-21(28)20-17-7-5-6-8-18(17)22(29)27(26-20)14(2)3/h5-14H,4H2,1-3H3,(H,24,25,28)