N-[(E)-[5-chloranyl-1-(2-chlorophenyl)-3-methyl-pyrazol-4-yl]methylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(E)-[5-chloranyl-1-(2-chlorophenyl)-3-methyl-pyrazol-4-yl]methylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(E)-[5-chloro-1-(2-chlorophenyl)-3-methyl-pyrazol-4-yl]methyleneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(E)-[5-chloro-1-(2-chlorophenyl)-3-methyl-4-pyrazolyl]methylideneamino]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(E)-[5-chloro-1-(2-chlorophenyl)-3-methylpyrazol-4-yl]methylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [(E)-[5-chloro-1-(2-chlorophenyl)-3-methyl-pyrazol-4-yl]methyleneamino]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C21H20Cl2N6O4S MolecularWeight: 523.3923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])Cl)C4=CC=CC=C4Cl

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])Cl)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H20Cl2N6O4S/c1-14-16(21(23)28(26-14)19-7-3-2-6-17(19)22)13-24-25-18-9-8-15(12-20(18)29(30)31)34(32,33)27-10-4-5-11-27/h2-3,6-9,12-13,25H,4-5,10-11H2,1H3/b24-13+