3-nitro-N-(2-phenylpyrimidin-5-yl)-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-(2-phenylpyrimidin-5-yl)-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-nitro-N-(2-phenylpyrimidin-5-yl)-4-pyrrolidin-1-yl-benzamide CAS Name: 3-nitro-N-(2-phenyl-5-pyrimidinyl)-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-nitro-N-(2-phenylpyrimidin-5-yl)-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-nitro-N-(2-phenylpyrimidin-5-yl)-4-pyrrolidino-benzamide Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CN=C(N=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CN=C(N=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N5O3/c27-21(24-17-13-22-20(23-14-17)15-6-2-1-3-7-15)16-8-9-18(19(12-16)26(28)29)25-10-4-5-11-25/h1-3,6-9,12-14H,4-5,10-11H2,(H,24,27)