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

Systemtic Name: N-methyl-2-nitro-4-piperidin-1-ylsulfonyl-N-(thiophen-3-ylmethyl)aniline Openeye Name: N-methyl-2-nitro-4-(1-piperidylsulfonyl)-N-(3-thienylmethyl)aniline CAS Name: N-methyl-2-nitro-4-(1-piperidinylsulfonyl)-N-(3-thiophenylmethyl)aniline IUPAC Name: N-methyl-2-nitro-4-piperidin-1-ylsulfonyl-N-(thiophen-3-ylmethyl)aniline Traditional Name: methyl-(2-nitro-4-piperidinosulfonyl-phenyl)-(3-thenyl)amine Formula: C17H21N3O4S2 MolecularWeight: 395.49634

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CSC=C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O4S2/c1-18(12-14-7-10-25-13-14)16-6-5-15(11-17(16)20(21)22)26(23,24)19-8-3-2-4-9-19/h5-7,10-11,13H,2-4,8-9,12H2,1H3