3-(but-3-ynylamino)-5-chloranyl-1-(phenylmethyl)pyrazin-2-one

Systemtic Name: 3-(but-3-ynylamino)-5-chloranyl-1-(phenylmethyl)pyrazin-2-one Openeye Name: 1-benzyl-3-(but-3-ynylamino)-5-chloro-pyrazin-2-one CAS Name: 3-(but-3-ynylamino)-5-chloro-1-(phenylmethyl)-2-pyrazinone IUPAC Name: 1-benzyl-3-(but-3-ynylamino)-5-chloropyrazin-2-one Traditional Name: 1-benzyl-3-(but-3-ynylamino)-5-chloro-pyrazin-2-one Formula: C15H14ClN3O MolecularWeight: 287.74416

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCNC1=NC(=CN(C1=O)CC2=CC=CC=C2)Cl

Isomeric SMILES

C#CCCNC1=NC(=CN(C1=O)CC2=CC=CC=C2)Cl

InChI

InChI=1S/C15H14ClN3O/c1-2-3-9-17-14-15(20)19(11-13(16)18-14)10-12-7-5-4-6-8-12/h1,4-8,11H,3,9-10H2,(H,17,18)