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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C=CC2=CC=CC=C2OC

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)/C=C/C2=CC=CC=C2OC

InChI

InChI=1S/C22H25N3O3S/c1-22(2,3)20(27)23-16-9-7-10-17(14-16)24-21(29)25-19(26)13-12-15-8-5-6-11-18(15)28-4/h5-14H,1-4H3,(H,23,27)(H2,24,25,26,29)/b13-12+