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

Systemtic Name: 2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]carbamothioylamino]-N-(4-ethoxyphenyl)benzamide Openeye Name: 2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]carbamothioylamino]-N-(4-ethoxyphenyl)benzamide CAS Name: 2-[[[[(E)-3-(2-chlorophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-(4-ethoxyphenyl)benzamide IUPAC Name: 2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]carbamothioylamino]-N-(4-ethoxyphenyl)benzamide Traditional Name: 2-[[(E)-3-(2-chlorophenyl)acryloyl]thiocarbamoylamino]-N-p-phenetyl-benzamide Formula: C25H22ClN3O3S MolecularWeight: 479.97848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C=CC3=CC=CC=C3Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)/C=C/C3=CC=CC=C3Cl

InChI

InChI=1S/C25H22ClN3O3S/c1-2-32-19-14-12-18(13-15-19)27-24(31)20-8-4-6-10-22(20)28-25(33)29-23(30)16-11-17-7-3-5-9-21(17)26/h3-16H,2H2,1H3,(H,27,31)(H2,28,29,30,33)/b16-11+