N-[2-[[2-phenyl-6-[4-(3-thiophen-2-ylpropanoyl)piperazin-1-yl]pyrimidin-4-yl]amino]ethyl]ethanamide

Systemtic Name: N-[2-[[2-phenyl-6-[4-(3-thiophen-2-ylpropanoyl)piperazin-1-yl]pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[2-phenyl-6-[4-[3-(2-thienyl)propanoyl]piperazin-1-yl]pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[6-[4-(1-oxo-3-thiophen-2-ylpropyl)-1-piperazinyl]-2-phenyl-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[[2-phenyl-6-[4-(3-thiophen-2-ylpropanoyl)piperazin-1-yl]pyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[2-phenyl-6-[4-[3-(2-thienyl)propanoyl]piperazino]pyrimidin-4-yl]amino]ethyl]acetamide Formula: C25H30N6O2S MolecularWeight: 478.6097

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)N2CCN(CC2)C(=O)CCC3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)N2CCN(CC2)C(=O)CCC3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N6O2S/c1-19(32)26-11-12-27-22-18-23(29-25(28-22)20-6-3-2-4-7-20)30-13-15-31(16-14-30)24(33)10-9-21-8-5-17-34-21/h2-8,17-18H,9-16H2,1H3,(H,26,32)(H,27,28,29)