N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-N-(thiophen-3-ylmethyl)aniline

Systemtic Name: N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-N-(thiophen-3-ylmethyl)aniline Openeye Name: N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-N-(3-thienylmethyl)aniline CAS Name: N-methyl-2-nitro-4-(1-pyrrolidinylsulfonyl)-N-(3-thiophenylmethyl)aniline IUPAC Name: N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-N-(thiophen-3-ylmethyl)aniline Traditional Name: methyl-(2-nitro-4-pyrrolidinosulfonyl-phenyl)-(3-thenyl)amine Formula: C16H19N3O4S2 MolecularWeight: 381.46976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O4S2/c1-17(11-13-6-9-24-12-13)15-5-4-14(10-16(15)19(20)21)25(22,23)18-7-2-3-8-18/h4-6,9-10,12H,2-3,7-8,11H2,1H3