N-[2-methyl-6-(3-phenylpropylamino)-4-sulfanylidene-1H-pyrimidin-5-yl]-2-(3-phenylpropylamino)ethanamide

Systemtic Name: N-[2-methyl-6-(3-phenylpropylamino)-4-sulfanylidene-1H-pyrimidin-5-yl]-2-(3-phenylpropylamino)ethanamide Openeye Name: N-[2-methyl-6-(3-phenylpropylamino)-4-thioxo-1H-pyrimidin-5-yl]-2-(3-phenylpropylamino)acetamide CAS Name: N-[2-methyl-6-(3-phenylpropylamino)-4-sulfanylidene-1H-pyrimidin-5-yl]-2-(3-phenylpropylamino)acetamide IUPAC Name: N-[2-methyl-6-(3-phenylpropylamino)-4-sulfanylidene-1H-pyrimidin-5-yl]-2-(3-phenylpropylamino)acetamide Traditional Name: N-[2-methyl-6-(3-phenylpropylamino)-4-thioxo-1H-pyrimidin-5-yl]-2-(3-phenylpropylamino)acetamide Formula: C25H31N5OS MolecularWeight: 449.61154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=S)C(=C(N1)NCCCC2=CC=CC=C2)NC(=O)CNCCCC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=S)C(=C(N1)NCCCC2=CC=CC=C2)NC(=O)CNCCCC3=CC=CC=C3

InChI

InChI=1S/C25H31N5OS/c1-19-28-24(27-17-9-15-21-12-6-3-7-13-21)23(25(32)29-19)30-22(31)18-26-16-8-14-20-10-4-2-5-11-20/h2-7,10-13,26H,8-9,14-18H2,1H3,(H,30,31)(H2,27,28,29,32)