2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-methyl-N-[(4-propan-2-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-methyl-N-[(4-propan-2-ylphenyl)methyl]ethanamide Openeye Name: N-[(4-isopropylphenyl)methyl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-methyl-acetamide CAS Name: 2-[(4-methoxy-3-nitrophenyl)methylthio]-N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide IUPAC Name: 2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]-N-methyl-N-[(4-propan-2-ylphenyl)methyl]acetamide Traditional Name: N-(4-isopropylbenzyl)-2-[(4-methoxy-3-nitro-benzyl)thio]-N-methyl-acetamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(C)C(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN(C)C(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H26N2O4S/c1-15(2)18-8-5-16(6-9-18)12-22(3)21(24)14-28-13-17-7-10-20(27-4)19(11-17)23(25)26/h5-11,15H,12-14H2,1-4H3