N-(2,6-dimethylphenyl)-2-[ethyl-[(4-methoxyphenyl)methylcarbamothioyl]amino]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[ethyl-[(4-methoxyphenyl)methylcarbamothioyl]amino]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[ethyl-[(4-methoxyphenyl)methylcarbamothioyl]amino]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[ethyl-[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]amino]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[ethyl-[(4-methoxyphenyl)methylcarbamothioyl]amino]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[ethyl(p-anisylthiocarbamoyl)amino]acetamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=C(C=CC=C1C)C)C(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CCN(CC(=O)NC1=C(C=CC=C1C)C)C(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H27N3O2S/c1-5-24(14-19(25)23-20-15(2)7-6-8-16(20)3)21(27)22-13-17-9-11-18(26-4)12-10-17/h6-12H,5,13-14H2,1-4H3,(H,22,27)(H,23,25)