1-[6-methyl-1-(phenylmethyl)-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[6-methyl-1-(phenylmethyl)-4-(4-phenylpiperazin-1-yl)-2-sulfanylidene-pyrimidin-5-yl]ethanone Openeye Name: 1-[1-benzyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-thioxo-pyrimidin-5-yl]ethanone CAS Name: 1-[6-methyl-1-(phenylmethyl)-4-(4-phenyl-1-piperazinyl)-2-sulfanylidene-5-pyrimidinyl]ethanone IUPAC Name: 1-[1-benzyl-6-methyl-4-(4-phenylpiperazin-1-yl)-2-sulfanylidenepyrimidin-5-yl]ethanone Traditional Name: 1-[1-benzyl-6-methyl-4-(4-phenylpiperazino)-2-thioxo-pyrimidin-5-yl]ethanone Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=S)N1CC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=S)N1CC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C24H26N4OS/c1-18-22(19(2)29)23(25-24(30)28(18)17-20-9-5-3-6-10-20)27-15-13-26(14-16-27)21-11-7-4-8-12-21/h3-12H,13-17H2,1-2H3