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

Systemtic Name: N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[2-(2-methylthiazol-4-yl)ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(2-methyl-4-thiazolyl)ethyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[2-(2-methylthiazol-4-yl)ethyl]phthalazine-1-carboxamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CS1)CCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2S/c1-15-24-17(14-29-15)11-12-23-21(27)20-18-9-5-6-10-19(18)22(28)26(25-20)13-16-7-3-2-4-8-16/h2-10,14H,11-13H2,1H3,(H,23,27)