N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(phenylcarbamothioylamino)benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(phenylcarbamothioylamino)benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(phenylcarbamothioylamino)benzamide CAS Name: 2-[[anilino(sulfanylidene)methyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(phenylcarbamothioylamino)benzamide Traditional Name: N-homoveratryl-2-(phenylthiocarbamoylamino)benzamide Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=S)NC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=S)NC3=CC=CC=C3)OC

InChI

InChI=1S/C24H25N3O3S/c1-29-21-13-12-17(16-22(21)30-2)14-15-25-23(28)19-10-6-7-11-20(19)27-24(31)26-18-8-4-3-5-9-18/h3-13,16H,14-15H2,1-2H3,(H,25,28)(H2,26,27,31)