2-[(4-chlorophenyl)methyl-(4-nitrophenyl)amino]-N-cyclohexyl-4-methyl-pentanethioamide

Systemtic Name: 2-[(4-chlorophenyl)methyl-(4-nitrophenyl)amino]-N-cyclohexyl-4-methyl-pentanethioamide Openeye Name: 2-[N-[(4-chlorophenyl)methyl]-4-nitro-anilino]-N-cyclohexyl-4-methyl-pentanethioamide CAS Name: 2-[N-[(4-chlorophenyl)methyl]-4-nitroanilino]-N-cyclohexyl-4-methylpentanethioamide IUPAC Name: 2-[N-[(4-chlorophenyl)methyl]-4-nitroanilino]-N-cyclohexyl-4-methylpentanethioamide Traditional Name: 2-(N-(4-chlorobenzyl)-4-nitro-anilino)-N-cyclohexyl-4-methyl-thiovaleramide Formula: C25H32ClN3O2S MolecularWeight: 474.05848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=S)NC1CCCCC1)N(CC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(C(=S)NC1CCCCC1)N(CC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H32ClN3O2S/c1-18(2)16-24(25(32)27-21-6-4-3-5-7-21)28(17-19-8-10-20(26)11-9-19)22-12-14-23(15-13-22)29(30)31/h8-15,18,21,24H,3-7,16-17H2,1-2H3,(H,27,32)