N-[4-[3-(dimethylamino)propylcarbamothioylamino]-2,5-diethoxy-phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[3-(dimethylamino)propylcarbamothioylamino]-2,5-diethoxy-phenyl]furan-2-carboxamide Openeye Name: N-[4-[3-(dimethylamino)propylcarbamothioylamino]-2,5-diethoxy-phenyl]furan-2-carboxamide CAS Name: N-[4-[[[3-(dimethylamino)propylamino]-sulfanylidenemethyl]amino]-2,5-diethoxyphenyl]-2-furancarboxamide IUPAC Name: N-[4-[3-(dimethylamino)propylcarbamothioylamino]-2,5-diethoxyphenyl]furan-2-carboxamide Traditional Name: N-[4-[3-(dimethylamino)propylthiocarbamoylamino]-2,5-diethoxy-phenyl]-2-furamide Formula: C21H30N4O4S MolecularWeight: 434.5523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CO2)OCC)NC(=S)NCCCN(C)C

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CO2)OCC)NC(=S)NCCCN(C)C

InChI

InChI=1S/C21H30N4O4S/c1-5-27-18-14-16(24-21(30)22-10-8-11-25(3)4)19(28-6-2)13-15(18)23-20(26)17-9-7-12-29-17/h7,9,12-14H,5-6,8,10-11H2,1-4H3,(H,23,26)(H2,22,24,30)