1-ethyl-4-[[2-[(5-phenyl-1,3-thiazol-2-yl)amino]pyridin-4-yl]methyl]piperazine-2,3-dione

Systemtic Name: 1-ethyl-4-[[2-[(5-phenyl-1,3-thiazol-2-yl)amino]pyridin-4-yl]methyl]piperazine-2,3-dione Openeye Name: 1-ethyl-4-[[2-[(5-phenylthiazol-2-yl)amino]-4-pyridyl]methyl]piperazine-2,3-dione CAS Name: 1-ethyl-4-[[2-[(5-phenyl-2-thiazolyl)amino]-4-pyridinyl]methyl]piperazine-2,3-dione IUPAC Name: 1-ethyl-4-[[2-[(5-phenyl-1,3-thiazol-2-yl)amino]pyridin-4-yl]methyl]piperazine-2,3-dione Traditional Name: 1-ethyl-4-[[2-[(5-phenylthiazol-2-yl)amino]-4-pyridyl]methyl]piperazine-2,3-quinone Formula: C21H21N5O2S MolecularWeight: 407.48874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(C(=O)C1=O)CC2=CC(=NC=C2)NC3=NC=C(S3)C4=CC=CC=C4

Isomeric SMILES

CCN1CCN(C(=O)C1=O)CC2=CC(=NC=C2)NC3=NC=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O2S/c1-2-25-10-11-26(20(28)19(25)27)14-15-8-9-22-18(12-15)24-21-23-13-17(29-21)16-6-4-3-5-7-16/h3-9,12-13H,2,10-11,14H2,1H3,(H,22,23,24)