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

Systemtic Name: N-[6-(dipropylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-[phenyl(propyl)amino]pentanamide Openeye Name: N-[6-(dipropylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]-5-(N-propylanilino)pentanamide CAS Name: N-[6-(dipropylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-(N-propylanilino)pentanamide IUPAC Name: N-[6-(dipropylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-(N-propylanilino)pentanamide Traditional Name: N-[6-(dipropylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]-5-(N-propylanilino)valeramide Formula: C25H39N5OS MolecularWeight: 457.67506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H39N5OS/c1-5-16-29(21-13-9-8-10-14-21)19-12-11-15-22(31)28-23-24(26-20(4)27-25(23)32)30(17-6-2)18-7-3/h8-10,13-14H,5-7,11-12,15-19H2,1-4H3,(H,28,31)(H,26,27,32)