N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-3-[hexyl(phenyl)amino]propanamide

Systemtic Name: N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-3-[hexyl(phenyl)amino]propanamide Openeye Name: N-[6-(diethylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]-3-(N-hexylanilino)propanamide CAS Name: N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-3-(N-hexylanilino)propanamide IUPAC Name: N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-3-(N-hexylanilino)propanamide Traditional Name: N-[6-(diethylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]-3-(N-hexylanilino)propionamide Formula: C24H37N5OS MolecularWeight: 443.64848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCC(=O)NC1=C(NC(=NC1=S)C)N(CC)CC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCN(CCC(=O)NC1=C(NC(=NC1=S)C)N(CC)CC)C2=CC=CC=C2

InChI

InChI=1S/C24H37N5OS/c1-5-8-9-13-17-29(20-14-11-10-12-15-20)18-16-21(30)27-22-23(28(6-2)7-3)25-19(4)26-24(22)31/h10-12,14-15H,5-9,13,16-18H2,1-4H3,(H,27,30)(H,25,26,31)