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

Systemtic Name: 3-methyl-4-nitro-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)benzamide Openeye Name: 3-methyl-4-nitro-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 3-methyl-4-nitro-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 3-methyl-4-nitro-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)benzamide Traditional Name: 3-methyl-4-nitro-N-[2-pyrrolidino-2-(2-thienyl)ethyl]benzamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC(C2=CC=CS2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC(C2=CC=CS2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O3S/c1-13-11-14(6-7-15(13)21(23)24)18(22)19-12-16(17-5-4-10-25-17)20-8-2-3-9-20/h4-7,10-11,16H,2-3,8-9,12H2,1H3,(H,19,22)