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

Systemtic Name: 3-nitro-4-pyrrolidin-1-yl-N-(1-thiophen-2-ylethyl)benzamide Openeye Name: 3-nitro-4-pyrrolidin-1-yl-N-[1-(2-thienyl)ethyl]benzamide CAS Name: 3-nitro-4-(1-pyrrolidinyl)-N-(1-thiophen-2-ylethyl)benzamide IUPAC Name: 3-nitro-4-pyrrolidin-1-yl-N-(1-thiophen-2-ylethyl)benzamide Traditional Name: 3-nitro-4-pyrrolidino-N-[1-(2-thienyl)ethyl]benzamide Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CS1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3S/c1-12(16-5-4-10-24-16)18-17(21)13-6-7-14(15(11-13)20(22)23)19-8-2-3-9-19/h4-7,10-12H,2-3,8-9H2,1H3,(H,18,21)