1-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-4-(4-nitrophenyl)piperazine

Systemtic Name: 1-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-4-(4-nitrophenyl)piperazine Openeye Name: 1-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-4-(4-nitrophenyl)piperazine CAS Name: 1-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonyl]-4-(4-nitrophenyl)piperazine IUPAC Name: 1-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonyl-4-(4-nitrophenyl)piperazine Traditional Name: 1-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-4-(4-nitrophenyl)piperazine Formula: C15H18ClN5O4S MolecularWeight: 399.85252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C15H18ClN5O4S/c1-11-14(15(16)18(2)17-11)26(24,25)20-9-7-19(8-10-20)12-3-5-13(6-4-12)21(22)23/h3-6H,7-10H2,1-2H3