3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-(3-methylphenyl)benzamide

Systemtic Name: 3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-(3-methylphenyl)benzamide Openeye Name: 3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-(m-tolyl)benzamide CAS Name: 3-[[[[(E)-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-(3-methylphenyl)benzamide Traditional Name: N-(m-tolyl)-3-[[(E)-3-p-phenetylacryloyl]thiocarbamoylamino]benzamide Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C26H25N3O3S/c1-3-32-23-13-10-19(11-14-23)12-15-24(30)29-26(33)28-22-9-5-7-20(17-22)25(31)27-21-8-4-6-18(2)16-21/h4-17H,3H2,1-2H3,(H,27,31)(H2,28,29,30,33)/b15-12+