3-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]phenyl]-N,N-dimethyl-propanamide

Systemtic Name: 3-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]phenyl]-N,N-dimethyl-propanamide Openeye Name: 3-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]phenyl]-N,N-dimethyl-propanamide CAS Name: 3-[3-[[[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]-N,N-dimethylpropanamide IUPAC Name: 3-[3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]phenyl]-N,N-dimethylpropanamide Traditional Name: 3-[3-[[(E)-3-(4-methoxyphenyl)acryloyl]thiocarbamoylamino]phenyl]-N,N-dimethyl-propionamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCC1=CC(=CC=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)OC

Isomeric SMILES

CN(C)C(=O)CCC1=CC(=CC=C1)NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)OC

InChI

InChI=1S/C22H25N3O3S/c1-25(2)21(27)14-10-17-5-4-6-18(15-17)23-22(29)24-20(26)13-9-16-7-11-19(28-3)12-8-16/h4-9,11-13,15H,10,14H2,1-3H3,(H2,23,24,26,29)/b13-9+