1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-(thiophen-3-ylmethyl)piperazine

Systemtic Name: 1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-(thiophen-3-ylmethyl)piperazine Openeye Name: 1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-(3-thienylmethyl)piperazine CAS Name: 1-(2,3-dimethyl-5-nitrophenyl)sulfonyl-4-(3-thiophenylmethyl)piperazine IUPAC Name: 1-(2,3-dimethyl-5-nitrophenyl)sulfonyl-4-(thiophen-3-ylmethyl)piperazine Traditional Name: 1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-4-(3-thenyl)piperazine Formula: C17H21N3O4S2 MolecularWeight: 395.49634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2)CC3=CSC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2)CC3=CSC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O4S2/c1-13-9-16(20(21)22)10-17(14(13)2)26(23,24)19-6-4-18(5-7-19)11-15-3-8-25-12-15/h3,8-10,12H,4-7,11H2,1-2H3