2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[4-(2,5-dimethylphenyl)-1-oxo-phthalazin-2-yl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[4-(2,5-dimethylphenyl)-1-oxo-2-phthalazinyl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[4-(2,5-dimethylphenyl)-1-oxophthalazin-2-yl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[4-(2,5-dimethylphenyl)-1-keto-phthalazin-2-yl]-N-(2-thenyl)acetamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)NCC4=CC=CS4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)CC(=O)NCC4=CC=CS4

InChI

InChI=1S/C23H21N3O2S/c1-15-9-10-16(2)20(12-15)22-18-7-3-4-8-19(18)23(28)26(25-22)14-21(27)24-13-17-6-5-11-29-17/h3-12H,13-14H2,1-2H3,(H,24,27)