N-[4-methyl-3-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]carbamothioylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-methyl-3-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]carbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[3-[[(E)-3-(4-isopropylphenyl)prop-2-enoyl]carbamothioylamino]-4-methyl-phenyl]furan-2-carboxamide CAS Name: N-[4-methyl-3-[[[[(E)-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-methyl-3-[[(E)-3-(4-propan-2-ylphenyl)prop-2-enoyl]carbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[4-methyl-3-[[(E)-3-p-cumenylacryloyl]thiocarbamoylamino]phenyl]-2-furamide Formula: C25H25N3O3S MolecularWeight: 447.5493

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)NC(=S)NC(=O)C=CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)NC(=S)NC(=O)/C=C/C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C25H25N3O3S/c1-16(2)19-10-7-18(8-11-19)9-13-23(29)28-25(32)27-21-15-20(12-6-17(21)3)26-24(30)22-5-4-14-31-22/h4-16H,1-3H3,(H,26,30)(H2,27,28,29,32)/b13-9+