1-[(5-chloranylthiophen-2-yl)methyl]-4-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperazine

Systemtic Name: 1-[(5-chloranylthiophen-2-yl)methyl]-4-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperazine Openeye Name: 1-[(5-chloro-2-thienyl)methyl]-4-[2-nitro-4-(1-piperidylsulfonyl)phenyl]piperazine CAS Name: 1-[(5-chloro-2-thiophenyl)methyl]-4-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]piperazine IUPAC Name: 1-[(5-chlorothiophen-2-yl)methyl]-4-(2-nitro-4-piperidin-1-ylsulfonylphenyl)piperazine Traditional Name: 1-[(5-chloro-2-thienyl)methyl]-4-(2-nitro-4-piperidinosulfonyl-phenyl)piperazine Formula: C20H25ClN4O4S2 MolecularWeight: 485.0199

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC4=CC=C(S4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC4=CC=C(S4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H25ClN4O4S2/c21-20-7-4-16(30-20)15-22-10-12-23(13-11-22)18-6-5-17(14-19(18)25(26)27)31(28,29)24-8-2-1-3-9-24/h4-7,14H,1-3,8-13,15H2