2-[[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-ethyl-amino]ethanenitrile

Systemtic Name: 2-[[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-ethyl-amino]ethanenitrile Openeye Name: 2-[(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-ethyl-amino]acetonitrile CAS Name: 2-[[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-ethylamino]acetonitrile IUPAC Name: 2-[(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-ethylamino]acetonitrile Traditional Name: 2-[(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-ethyl-amino]acetonitrile Formula: C15H17N5O2 MolecularWeight: 299.32778

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC#N)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N

Isomeric SMILES

CCN(CC#N)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N

InChI

InChI=1S/C15H17N5O2/c1-2-19(9-8-16)12-13(17)20(15(22)18-14(12)21)10-11-6-4-3-5-7-11/h3-7H,2,9-10,17H2,1H3,(H,18,21,22)