N-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]-1,3-thiazol-2-amine

Systemtic Name: N-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]-1,3-thiazol-2-amine Openeye Name: N-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]thiazol-2-amine CAS Name: N-[5-nitro-6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]-2-thiazolamine IUPAC Name: N-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]-1,3-thiazol-2-amine Traditional Name: [5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]-thiazol-2-yl-amine Formula: C17H17N7O2S MolecularWeight: 383.42758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=NC=N3)NC4=NC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=NC=N3)NC4=NC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C17H17N7O2S/c25-24(26)14-15(21-17-18-6-11-27-17)19-12-20-16(14)23-9-7-22(8-10-23)13-4-2-1-3-5-13/h1-6,11-12H,7-10H2,(H,18,19,20,21)