N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-N-(phenylmethyl)ethanamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(3-methyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(3-methyl-4-oxo-1-phthalazinyl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(3-methyl-4-oxophthalazin-1-yl)acetamide Traditional Name: N-benzyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(4-keto-3-methyl-phthalazin-1-yl)acetamide Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CC4=NN(C(=O)C5=CC=CC=C54)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CC4=NN(C(=O)C5=CC=CC=C54)C)C

InChI

InChI=1S/C27H24N4O2S/c1-17-13-18(2)25-23(14-17)34-27(28-25)31(16-19-9-5-4-6-10-19)24(32)15-22-20-11-7-8-12-21(20)26(33)30(3)29-22/h4-14H,15-16H2,1-3H3