3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-N-[(4-methylphenyl)methyl]propanethioamide

Systemtic Name: 3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-N-[(4-methylphenyl)methyl]propanethioamide Openeye Name: 3-(3-ethoxy-4-prop-2-ynoxy-phenyl)-N-(p-tolylmethyl)propanethioamide CAS Name: 3-(3-ethoxy-4-prop-2-ynoxyphenyl)-N-[(4-methylphenyl)methyl]propanethioamide IUPAC Name: 3-(3-ethoxy-4-prop-2-ynoxyphenyl)-N-[(4-methylphenyl)methyl]propanethioamide Traditional Name: 3-(3-ethoxy-4-propargyloxy-phenyl)-N-(4-methylbenzyl)thiopropionamide Formula: C22H25NO2S MolecularWeight: 367.5044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CCC(=S)NCC2=CC=C(C=C2)C)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)CCC(=S)NCC2=CC=C(C=C2)C)OCC#C

InChI

InChI=1S/C22H25NO2S/c1-4-14-25-20-12-10-18(15-21(20)24-5-2)11-13-22(26)23-16-19-8-6-17(3)7-9-19/h1,6-10,12,15H,5,11,13-14,16H2,2-3H3,(H,23,26)