2-[[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]methyl]phthalazin-1-one

Systemtic Name: 2-[[(5-chloranylthiophen-2-yl)methyl-ethyl-amino]methyl]phthalazin-1-one Openeye Name: 2-[[(5-chloro-2-thienyl)methyl-ethyl-amino]methyl]phthalazin-1-one CAS Name: 2-[[(5-chloro-2-thiophenyl)methyl-ethylamino]methyl]-1-phthalazinone IUPAC Name: 2-[[(5-chlorothiophen-2-yl)methyl-ethylamino]methyl]phthalazin-1-one Traditional Name: 2-[[(5-chloro-2-thienyl)methyl-ethyl-amino]methyl]phthalazin-1-one Formula: C16H16ClN3OS MolecularWeight: 333.83574

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)CN2C(=O)C3=CC=CC=C3C=N2

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)CN2C(=O)C3=CC=CC=C3C=N2

InChI

InChI=1S/C16H16ClN3OS/c1-2-19(10-13-7-8-15(17)22-13)11-20-16(21)14-6-4-3-5-12(14)9-18-20/h3-9H,2,10-11H2,1H3