3-methyl-N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[5-(m-tolylmethyl)thiazol-2-yl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[5-[(3-methylphenyl)methyl]-2-thiazolyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[5-(3-methylbenzyl)thiazol-2-yl]phthalazine-1-carboxamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=CN=C(S2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2=CN=C(S2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C21H18N4O2S/c1-13-6-5-7-14(10-13)11-15-12-22-21(28-15)23-19(26)18-16-8-3-4-9-17(16)20(27)25(2)24-18/h3-10,12H,11H2,1-2H3,(H,22,23,26)