N-[6-(dibutylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-[phenyl(propyl)amino]pentanamide

Systemtic Name: N-[6-(dibutylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-[phenyl(propyl)amino]pentanamide Openeye Name: N-[6-(dibutylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]-5-(N-propylanilino)pentanamide CAS Name: N-[6-(dibutylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-(N-propylanilino)pentanamide IUPAC Name: N-[6-(dibutylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-(N-propylanilino)pentanamide Traditional Name: N-[6-(dibutylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]-5-(N-propylanilino)valeramide Formula: C27H43N5OS MolecularWeight: 485.72822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=C(C(=S)N=C(N1)C)NC(=O)CCCCN(CCC)C2=CC=CC=C2

Isomeric SMILES

CCCCN(CCCC)C1=C(C(=S)N=C(N1)C)NC(=O)CCCCN(CCC)C2=CC=CC=C2

InChI

InChI=1S/C27H43N5OS/c1-5-8-19-32(20-9-6-2)26-25(27(34)29-22(4)28-26)30-24(33)17-13-14-21-31(18-7-3)23-15-11-10-12-16-23/h10-12,15-16H,5-9,13-14,17-21H2,1-4H3,(H,30,33)(H,28,29,34)