2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(3-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(3-methylsulfanylphenyl)ethanamide Openeye Name: 2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(3-methylsulfanylphenyl)acetamide CAS Name: 2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-[3-(methylthio)phenyl]acetamide IUPAC Name: 2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-N-(3-methylsulfanylphenyl)acetamide Traditional Name: 2-[cyclopropyl-(2,5-dimethoxybenzyl)amino]-N-[3-(methylthio)phenyl]acetamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(CC(=O)NC2=CC(=CC=C2)SC)C3CC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(CC(=O)NC2=CC(=CC=C2)SC)C3CC3

InChI

InChI=1S/C21H26N2O3S/c1-25-18-9-10-20(26-2)15(11-18)13-23(17-7-8-17)14-21(24)22-16-5-4-6-19(12-16)27-3/h4-6,9-12,17H,7-8,13-14H2,1-3H3,(H,22,24)