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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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