4-methyl-N-[2-[(2,3,4,5,6-pentamethylphenyl)methylsulfanyl]phenyl]piperazine-1-carboxamide

Systemtic Name: 4-methyl-N-[2-[(2,3,4,5,6-pentamethylphenyl)methylsulfanyl]phenyl]piperazine-1-carboxamide Openeye Name: 4-methyl-N-[2-[(2,3,4,5,6-pentamethylphenyl)methylsulfanyl]phenyl]piperazine-1-carboxamide CAS Name: 4-methyl-N-[2-[(2,3,4,5,6-pentamethylphenyl)methylthio]phenyl]-1-piperazinecarboxamide IUPAC Name: 4-methyl-N-[2-[(2,3,4,5,6-pentamethylphenyl)methylsulfanyl]phenyl]piperazine-1-carboxamide Traditional Name: 4-methyl-N-[2-[(2,3,4,5,6-pentamethylbenzyl)thio]phenyl]piperazine-1-carboxamide Formula: C24H33N3OS MolecularWeight: 411.60332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)CSC2=CC=CC=C2NC(=O)N3CCN(CC3)C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)CSC2=CC=CC=C2NC(=O)N3CCN(CC3)C)C)C

InChI

InChI=1S/C24H33N3OS/c1-16-17(2)19(4)21(20(5)18(16)3)15-29-23-10-8-7-9-22(23)25-24(28)27-13-11-26(6)12-14-27/h7-10H,11-15H2,1-6H3,(H,25,28)