3-nitro-4-pyrrolidin-1-yl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)benzamide

Systemtic Name: 3-nitro-4-pyrrolidin-1-yl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)benzamide Openeye Name: 3-nitro-4-pyrrolidin-1-yl-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 3-nitro-4-(1-pyrrolidinyl)-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 3-nitro-4-pyrrolidin-1-yl-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)benzamide Traditional Name: 3-nitro-4-pyrrolidino-N-[2-pyrrolidino-2-(2-thienyl)ethyl]benzamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCC(C3=CC=CS3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCC(C3=CC=CS3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O3S/c26-21(22-15-19(20-6-5-13-29-20)24-11-3-4-12-24)16-7-8-17(18(14-16)25(27)28)23-9-1-2-10-23/h5-8,13-14,19H,1-4,9-12,15H2,(H,22,26)