N-(2-cyclopentylsulfanylethyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-(2-cyclopentylsulfanylethyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-(2-cyclopentylsulfanylethyl)-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[2-(cyclopentylthio)ethyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-(2-cyclopentylsulfanylethyl)-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[2-(cyclopentylthio)ethyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SCCNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C1CCC(C1)SCCNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C16H19N3O2S/c20-15-13-8-4-3-7-12(13)14(18-19-15)16(21)17-9-10-22-11-5-1-2-6-11/h3-4,7-8,11H,1-2,5-6,9-10H2,(H,17,21)(H,19,20)