N-(cyclohexylmethyl)-2-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)ethanamide

Systemtic Name: N-(cyclohexylmethyl)-2-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)ethanamide Openeye Name: N-(cyclohexylmethyl)-2-[1-oxo-4-(2-thienyl)phthalazin-2-yl]acetamide CAS Name: N-(cyclohexylmethyl)-2-(1-oxo-4-thiophen-2-yl-2-phthalazinyl)acetamide IUPAC Name: N-(cyclohexylmethyl)-2-(1-oxo-4-thiophen-2-ylphthalazin-2-yl)acetamide Traditional Name: N-(cyclohexylmethyl)-2-[1-keto-4-(2-thienyl)phthalazin-2-yl]acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4

Isomeric SMILES

C1CCC(CC1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4

InChI

InChI=1S/C21H23N3O2S/c25-19(22-13-15-7-2-1-3-8-15)14-24-21(26)17-10-5-4-9-16(17)20(23-24)18-11-6-12-27-18/h4-6,9-12,15H,1-3,7-8,13-14H2,(H,22,25)