4-[4-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-N-cyclopropyl-3-nitro-benzamide

Systemtic Name: 4-[4-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-N-cyclopropyl-3-nitro-benzamide Openeye Name: 4-[4-[[5-(2-chlorophenyl)-2-thienyl]methyl]piperazin-1-yl]-N-cyclopropyl-3-nitro-benzamide CAS Name: 4-[4-[[5-(2-chlorophenyl)-2-thiophenyl]methyl]-1-piperazinyl]-N-cyclopropyl-3-nitrobenzamide IUPAC Name: 4-[4-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-N-cyclopropyl-3-nitrobenzamide Traditional Name: 4-[4-[[5-(2-chlorophenyl)-2-thienyl]methyl]piperazino]-N-cyclopropyl-3-nitro-benzamide Formula: C25H25ClN4O3S MolecularWeight: 497.009

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC4=CC=C(S4)C5=CC=CC=C5Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC4=CC=C(S4)C5=CC=CC=C5Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H25ClN4O3S/c26-21-4-2-1-3-20(21)24-10-8-19(34-24)16-28-11-13-29(14-12-28)22-9-5-17(15-23(22)30(32)33)25(31)27-18-6-7-18/h1-5,8-10,15,18H,6-7,11-14,16H2,(H,27,31)