[4-(3-chlorophenyl)sulfanyl-3-nitro-phenyl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [4-(3-chlorophenyl)sulfanyl-3-nitro-phenyl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [4-(3-chlorophenyl)sulfanyl-3-nitro-phenyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [4-[(3-chlorophenyl)thio]-3-nitrophenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [4-(3-chlorophenyl)sulfanyl-3-nitrophenyl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [4-[(3-chlorophenyl)thio]-3-nitro-phenyl]-(4-phenylpiperazino)methanone Formula: C23H20ClN3O3S MolecularWeight: 453.9412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)SC4=CC(=CC=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)SC4=CC(=CC=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H20ClN3O3S/c24-18-5-4-8-20(16-18)31-22-10-9-17(15-21(22)27(29)30)23(28)26-13-11-25(12-14-26)19-6-2-1-3-7-19/h1-10,15-16H,11-14H2