(E)-3-(4-methoxyphenyl)-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-methoxyphenyl)-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-methoxyphenyl)-N-[[(2-propoxybenzoyl)amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-methoxyphenyl)-N-[[[oxo-(2-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-methoxyphenyl)-N-[[(2-propoxybenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(4-methoxyphenyl)-N-[[(2-propoxybenzoyl)amino]thiocarbamoyl]acrylamide Formula: C21H23N3O4S MolecularWeight: 413.49002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)C=CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)/C=C/C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H23N3O4S/c1-3-14-28-18-7-5-4-6-17(18)20(26)23-24-21(29)22-19(25)13-10-15-8-11-16(27-2)12-9-15/h4-13H,3,14H2,1-2H3,(H,23,26)(H2,22,24,25,29)/b13-10+