N-[4-azanyl-2,6-bis(oxidanylidene)-1,3-dipropyl-pyrimidin-5-yl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[4-azanyl-2,6-bis(oxidanylidene)-1,3-dipropyl-pyrimidin-5-yl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-(4-amino-2,6-dioxo-1,3-dipropyl-pyrimidin-5-yl)-1-benzyl-pyrazole-4-carboxamide CAS Name: N-(4-amino-2,6-dioxo-1,3-dipropyl-5-pyrimidinyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-(4-amino-2,6-dioxo-1,3-dipropylpyrimidin-5-yl)-1-benzylpyrazole-4-carboxamide Traditional Name: N-(4-amino-2,6-diketo-1,3-dipropyl-pyrimidin-5-yl)-1-benzyl-pyrazole-4-carboxamide Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)CCC)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3)N

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)CCC)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3)N

InChI

InChI=1S/C21H26N6O3/c1-3-10-26-18(22)17(20(29)27(11-4-2)21(26)30)24-19(28)16-12-23-25(14-16)13-15-8-6-5-7-9-15/h5-9,12,14H,3-4,10-11,13,22H2,1-2H3,(H,24,28)