(4-imidazol-1-yl-3-nitro-phenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (4-imidazol-1-yl-3-nitro-phenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-(2-naphthylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(1-imidazolyl)-3-nitrophenyl]-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (4-imidazol-1-yl-3-nitrophenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-(2-naphthylsulfonyl)piperazino]methanone Formula: C24H21N5O5S MolecularWeight: 491.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H21N5O5S/c30-24(20-6-8-22(23(16-20)29(31)32)27-10-9-25-17-27)26-11-13-28(14-12-26)35(33,34)21-7-5-18-3-1-2-4-19(18)15-21/h1-10,15-17H,11-14H2