(3-nitro-4-pyrrolidin-1-yl-phenyl)-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-nitro-4-pyrrolidin-1-yl-phenyl)-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Openeye Name: (3-nitro-4-pyrrolidin-1-yl-phenyl)-[4-(2-thienylmethyl)piperazin-1-yl]methanone CAS Name: [3-nitro-4-(1-pyrrolidinyl)phenyl]-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (3-nitro-4-pyrrolidin-1-ylphenyl)-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Traditional Name: (3-nitro-4-pyrrolidino-phenyl)-[4-(2-thenyl)piperazino]methanone Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O3S/c25-20(23-11-9-21(10-12-23)15-17-4-3-13-28-17)16-5-6-18(19(14-16)24(26)27)22-7-1-2-8-22/h3-6,13-14H,1-2,7-12,15H2