3-methyl-4-oxidanylidene-N-phenethyl-N-(thiophen-2-ylmethyl)phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-phenethyl-N-(thiophen-2-ylmethyl)phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-phenethyl-N-(2-thienylmethyl)phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-phenethyl-N-(thiophen-2-ylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-phenethyl-N-(thiophen-2-ylmethyl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-phenethyl-N-(2-thenyl)phthalazine-1-carboxamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CCC3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CCC3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C23H21N3O2S/c1-25-22(27)20-12-6-5-11-19(20)21(24-25)23(28)26(16-18-10-7-15-29-18)14-13-17-8-3-2-4-9-17/h2-12,15H,13-14,16H2,1H3