2-nitro-N-[(E)-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylideneamino]-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: 2-nitro-N-[(E)-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylideneamino]-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: 2-nitro-N-[(E)-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: 2-nitro-N-[(E)-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylideneamino]-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: 2-nitro-N-[(E)-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylideneamino]-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: (2-nitro-4-pyrrolidinosulfonyl-phenyl)-[(E)-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]amine Formula: C24H22N6O4S2 MolecularWeight: 522.59928

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NN=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N/N=C/C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H22N6O4S2/c31-30(32)22-15-20(36(33,34)28-12-4-5-13-28)10-11-21(22)26-25-16-18-17-29(19-7-2-1-3-8-19)27-24(18)23-9-6-14-35-23/h1-3,6-11,14-17,26H,4-5,12-13H2/b25-16+