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

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-(thiophen-2-ylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-(2-thienylmethyl)phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-(thiophen-2-ylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-(thiophen-2-ylmethyl)phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-(2-thenyl)phthalazine-1-carboxamide Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C21H17N3O2S/c25-20(22-13-16-9-6-12-27-16)19-17-10-4-5-11-18(17)21(26)24(23-19)14-15-7-2-1-3-8-15/h1-12H,13-14H2,(H,22,25)