2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(2-phenylsulfanylethyl)ethanamide

Systemtic Name: 2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(2-phenylsulfanylethyl)ethanamide Openeye Name: 2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(2-phenylsulfanylethyl)acetamide CAS Name: 2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-[2-(phenylthio)ethyl]acetamide IUPAC Name: 2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(2-phenylsulfanylethyl)acetamide Traditional Name: 2-[cyclopropyl-(2,5-dimethoxybenzyl)amino]-N-[2-(phenylthio)ethyl]acetamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(CC(=O)NCCSC2=CC=CC=C2)C3CC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(CC(=O)NCCSC2=CC=CC=C2)C3CC3

InChI

InChI=1S/C22H28N2O3S/c1-26-19-10-11-21(27-2)17(14-19)15-24(18-8-9-18)16-22(25)23-12-13-28-20-6-4-3-5-7-20/h3-7,10-11,14,18H,8-9,12-13,15-16H2,1-2H3,(H,23,25)