N-[6-[ethyl-(phenylmethyl)amino]-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-(3-phenylpropylamino)pentanamide

Systemtic Name: N-[6-[ethyl-(phenylmethyl)amino]-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-(3-phenylpropylamino)pentanamide Openeye Name: N-[6-[benzyl(ethyl)amino]-2-methyl-4-thioxo-1H-pyrimidin-5-yl]-5-(3-phenylpropylamino)pentanamide CAS Name: N-[6-[ethyl-(phenylmethyl)amino]-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-(3-phenylpropylamino)pentanamide IUPAC Name: N-[6-[benzyl(ethyl)amino]-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-5-(3-phenylpropylamino)pentanamide Traditional Name: N-[6-[benzyl(ethyl)amino]-2-methyl-4-thioxo-1H-pyrimidin-5-yl]-5-(3-phenylpropylamino)valeramide Formula: C28H37N5OS MolecularWeight: 491.69128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=C(C(=S)N=C(N2)C)NC(=O)CCCCNCCCC3=CC=CC=C3

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=C(C(=S)N=C(N2)C)NC(=O)CCCCNCCCC3=CC=CC=C3

InChI

InChI=1S/C28H37N5OS/c1-3-33(21-24-15-8-5-9-16-24)27-26(28(35)31-22(2)30-27)32-25(34)18-10-11-19-29-20-12-17-23-13-6-4-7-14-23/h4-9,13-16,29H,3,10-12,17-21H2,1-2H3,(H,32,34)(H,30,31,35)