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

Systemtic Name: 3-[3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]phenyl]-N,N-dimethyl-propanamide Openeye Name: 3-[3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]phenyl]-N,N-dimethyl-propanamide CAS Name: 3-[3-[[[[(E)-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]-N,N-dimethylpropanamide IUPAC Name: 3-[3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]phenyl]-N,N-dimethylpropanamide Traditional Name: N,N-dimethyl-3-[3-[[(E)-3-p-phenetylacryloyl]thiocarbamoylamino]phenyl]propionamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC(=C2)CCC(=O)N(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=CC(=C2)CCC(=O)N(C)C

InChI

InChI=1S/C23H27N3O3S/c1-4-29-20-12-8-17(9-13-20)10-14-21(27)25-23(30)24-19-7-5-6-18(16-19)11-15-22(28)26(2)3/h5-10,12-14,16H,4,11,15H2,1-3H3,(H2,24,25,27,30)/b14-10+