2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[[6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]thio]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]sulfanyl-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[[6-(4-phenylpiperazino)pyrimidin-4-yl]thio]acetamide Formula: C25H29N5OS MolecularWeight: 447.59566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NC=NC(=C2)N3CCN(CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H29N5OS/c1-18-13-19(2)25(20(3)14-18)28-23(31)16-32-24-15-22(26-17-27-24)30-11-9-29(10-12-30)21-7-5-4-6-8-21/h4-8,13-15,17H,9-12,16H2,1-3H3,(H,28,31)