(5-nitro-2-pyrrolidin-1-yl-phenyl)-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (5-nitro-2-pyrrolidin-1-yl-phenyl)-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]methanone Openeye Name: (5-nitro-2-pyrrolidin-1-yl-phenyl)-[4-[(2-phenylthiazol-4-yl)methyl]piperazin-1-yl]methanone CAS Name: [5-nitro-2-(1-pyrrolidinyl)phenyl]-[4-[(2-phenyl-4-thiazolyl)methyl]-1-piperazinyl]methanone IUPAC Name: (5-nitro-2-pyrrolidin-1-ylphenyl)-[4-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]methanone Traditional Name: (5-nitro-2-pyrrolidino-phenyl)-[4-[(2-phenylthiazol-4-yl)methyl]piperazino]methanone Formula: C25H27N5O3S MolecularWeight: 477.57858

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)CC4=CSC(=N4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)CC4=CSC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C25H27N5O3S/c31-25(22-16-21(30(32)33)8-9-23(22)28-10-4-5-11-28)29-14-12-27(13-15-29)17-20-18-34-24(26-20)19-6-2-1-3-7-19/h1-3,6-9,16,18H,4-5,10-15,17H2