N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-4-[(phenylmethyl)-propyl-amino]butanamide

Systemtic Name: N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-4-[(phenylmethyl)-propyl-amino]butanamide Openeye Name: 4-[benzyl(propyl)amino]-N-[6-(diethylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]butanamide CAS Name: N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-4-[(phenylmethyl)-propylamino]butanamide IUPAC Name: 4-[benzyl(propyl)amino]-N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]butanamide Traditional Name: 4-[benzyl(propyl)amino]-N-[6-(diethylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]butyramide Formula: C23H35N5OS MolecularWeight: 429.6219

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC(=O)NC1=C(NC(=NC1=S)C)N(CC)CC)CC2=CC=CC=C2

Isomeric SMILES

CCCN(CCCC(=O)NC1=C(NC(=NC1=S)C)N(CC)CC)CC2=CC=CC=C2

InChI

InChI=1S/C23H35N5OS/c1-5-15-27(17-19-12-9-8-10-13-19)16-11-14-20(29)26-21-22(28(6-2)7-3)24-18(4)25-23(21)30/h8-10,12-13H,5-7,11,14-17H2,1-4H3,(H,26,29)(H,24,25,30)