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

Systemtic Name: 3-nitro-4-pyrrolidin-1-yl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Openeye Name: 3-nitro-4-pyrrolidin-1-yl-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]benzamide CAS Name: 3-nitro-4-(1-pyrrolidinyl)-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]benzamide IUPAC Name: 3-nitro-4-pyrrolidin-1-yl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Traditional Name: 3-nitro-4-pyrrolidino-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]benzamide Formula: C20H24N4O5S2 MolecularWeight: 464.55836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5S2/c25-20(15-5-7-17(18(13-15)24(26)27)22-9-1-2-10-22)21-14-16-6-8-19(30-16)31(28,29)23-11-3-4-12-23/h5-8,13H,1-4,9-12,14H2,(H,21,25)