N-(2-methyl-1-thiophen-2-yl-propyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(2-methyl-1-thiophen-2-yl-propyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[2-methyl-1-(2-thienyl)propyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(2-methyl-1-thiophen-2-ylpropyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(2-methyl-1-thiophen-2-ylpropyl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-methyl-1-(2-thienyl)propyl]-3-propyl-phthalazine-1-carboxamide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C3=CC=CS3)C(C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C3=CC=CS3)C(C)C

InChI

InChI=1S/C20H23N3O2S/c1-4-11-23-20(25)15-9-6-5-8-14(15)18(22-23)19(24)21-17(13(2)3)16-10-7-12-26-16/h5-10,12-13,17H,4,11H2,1-3H3,(H,21,24)