[4-(1,3-dithian-2-yl)phenyl]-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(2-nitrophenyl)sulfonylpiperazino]methanone Formula: C21H23N3O5S3 MolecularWeight: 493.61942

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5S3/c25-20(16-6-8-17(9-7-16)21-30-14-3-15-31-21)22-10-12-23(13-11-22)32(28,29)19-5-2-1-4-18(19)24(26)27/h1-2,4-9,21H,3,10-15H2