3-methyl-4-nitro-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide

Systemtic Name: 3-methyl-4-nitro-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Openeye Name: 3-methyl-4-nitro-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]benzamide CAS Name: 3-methyl-4-nitro-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]benzamide IUPAC Name: 3-methyl-4-nitro-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Traditional Name: 3-methyl-4-nitro-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]benzamide Formula: C17H19N3O5S2 MolecularWeight: 409.47986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O5S2/c1-12-10-13(4-6-15(12)20(22)23)17(21)18-11-14-5-7-16(26-14)27(24,25)19-8-2-3-9-19/h4-7,10H,2-3,8-9,11H2,1H3,(H,18,21)