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

Systemtic Name: 3-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-(3-methylphenyl)benzamide Openeye Name: 3-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-(m-tolyl)benzamide CAS Name: 3-[[[[(E)-3-(2-methoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 3-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-(3-methylphenyl)benzamide Traditional Name: 3-[[(E)-3-(2-methoxyphenyl)acryloyl]thiocarbamoylamino]-N-(m-tolyl)benzamide Formula: C25H23N3O3S MolecularWeight: 445.53342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C=CC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)/C=C/C3=CC=CC=C3OC

InChI

InChI=1S/C25H23N3O3S/c1-17-7-5-10-20(15-17)26-24(30)19-9-6-11-21(16-19)27-25(32)28-23(29)14-13-18-8-3-4-12-22(18)31-2/h3-16H,1-2H3,(H,26,30)(H2,27,28,29,32)/b14-13+