N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-2-(benzotriazol-1-yl)-N-ethyl-ethanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-2-(benzotriazol-1-yl)-N-ethyl-ethanamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-2-(benzotriazol-1-yl)-N-ethyl-acetamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-2-(1-benzotriazolyl)-N-ethylacetamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-2-(benzotriazol-1-yl)-N-ethylacetamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-2-(benzotriazol-1-yl)-N-ethyl-acetamide Formula: C21H21N7O3 MolecularWeight: 419.43654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H21N7O3/c1-2-26(17(29)13-28-16-11-7-6-10-15(16)24-25-28)18-19(22)27(21(31)23-20(18)30)12-14-8-4-3-5-9-14/h3-11H,2,12-13,22H2,1H3,(H,23,30,31)