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4-pyrimidin-5-yl-2-(thiophen-2-ylmethylamino)phthalazin-1-one

4-pyrimidin-5-yl-2-(thiophen-2-ylmethylamino)phthalazin-1-one

Systemtic Name:4-pyrimidin-5-yl-2-(thiophen-2-ylmethylamino)phthalazin-1-one
Openeye Name:4-pyrimidin-5-yl-2-(2-thienylmethylamino)phthalazin-1-one
CAS Name:4-(5-pyrimidinyl)-2-(thiophen-2-ylmethylamino)-1-phthalazinone
IUPAC Name:4-pyrimidin-5-yl-2-(thiophen-2-ylmethylamino)phthalazin-1-one
Traditional Name:4-(5-pyrimidyl)-2-(2-thenylamino)phthalazin-1-one
Formula: C17H13N5OS
MolecularWeight: 335.38302
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)NCC3=CC=CS3)C4=CN=CN=C4


Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)NCC3=CC=CS3)C4=CN=CN=C4


InChI

InChI=1S/C17H13N5OS/c23-17-15-6-2-1-5-14(15)16(12-8-18-11-19-9-12)21-22(17)20-10-13-4-3-7-24-13/h1-9,11,20H,10H2


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