methyl N'-[2-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-propanoyl]-N-methyl-N-phenyl-carbamimidothioate

Systemtic Name: methyl N'-[2-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-propanoyl]-N-methyl-N-phenyl-carbamimidothioate Openeye Name: 2-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-N-[(N-methylanilino)-methylsulfanyl-methylene]propanamide CAS Name: N'-[2-[(4-methoxyphenyl)methylthio]-2-methyl-1-oxopropyl]-N-methyl-N-phenylcarbamimidothioic acid methyl ester IUPAC Name: methyl N'-[2-[(4-methoxyphenyl)methylsulfanyl]-2-methylpropanoyl]-N-methyl-N-phenylcarbamimidothioate Traditional Name: 2-methyl-N-[(N-methylanilino)-(methylthio)methylene]-2-(p-anisylthio)propionamide Formula: C21H26N2O2S2 MolecularWeight: 402.57334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N=C(N(C)C1=CC=CC=C1)SC)SCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C(=O)N=C(N(C)C1=CC=CC=C1)SC)SCC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H26N2O2S2/c1-21(2,27-15-16-11-13-18(25-4)14-12-16)19(24)22-20(26-5)23(3)17-9-7-6-8-10-17/h6-14H,15H2,1-5H3