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

Systemtic Name: [4-(3-chlorophenyl)sulfanyl-3-nitro-phenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [4-(3-chlorophenyl)sulfanyl-3-nitro-phenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [4-[(3-chlorophenyl)thio]-3-nitrophenyl]-[4-(4-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(3-chlorophenyl)sulfanyl-3-nitrophenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [4-[(3-chlorophenyl)thio]-3-nitro-phenyl]-[4-(4-methoxyphenyl)piperazino]methanone Formula: C24H22ClN3O4S MolecularWeight: 483.96718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)SC4=CC(=CC=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)SC4=CC(=CC=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H22ClN3O4S/c1-32-20-8-6-19(7-9-20)26-11-13-27(14-12-26)24(29)17-5-10-23(22(15-17)28(30)31)33-21-4-2-3-18(25)16-21/h2-10,15-16H,11-14H2,1H3