N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide

Systemtic Name: N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide Openeye Name: N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-2-(2-thienyl)thiazole-4-carboxamide CAS Name: N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]-4-pyrimidinyl]-2-thiophen-2-yl-4-thiazolecarboxamide IUPAC Name: N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide Traditional Name: N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-2-(2-thienyl)thiazole-4-carboxamide Formula: C22H21N5OS2 MolecularWeight: 435.56504

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC(=NC=C1)NC(C)C2=CC=CC=C2)C(=O)C3=CSC(=N3)C4=CC=CS4

Isomeric SMILES

CCN(C1=NC(=NC=C1)N[C@H](C)C2=CC=CC=C2)C(=O)C3=CSC(=N3)C4=CC=CS4

InChI

InChI=1S/C22H21N5OS2/c1-3-27(21(28)17-14-30-20(25-17)18-10-7-13-29-18)19-11-12-23-22(26-19)24-15(2)16-8-5-4-6-9-16/h4-15H,3H2,1-2H3,(H,23,24,26)/t15-/m1/s1