2-(3,4-dihydro-2H-chromen-6-yl)-N,2-dimethyl-3-[(2-oxidanyl-2-pyrimidin-2-yl-ethyl)amino]butanamide

Systemtic Name: 2-(3,4-dihydro-2H-chromen-6-yl)-N,2-dimethyl-3-[(2-oxidanyl-2-pyrimidin-2-yl-ethyl)amino]butanamide Openeye Name: 2-chroman-6-yl-3-[(2-hydroxy-2-pyrimidin-2-yl-ethyl)amino]-N,2-dimethyl-butanamide CAS Name: 2-(3,4-dihydro-2H-1-benzopyran-6-yl)-3-[[2-hydroxy-2-(2-pyrimidinyl)ethyl]amino]-N,2-dimethylbutanamide IUPAC Name: 2-(3,4-dihydro-2H-chromen-6-yl)-3-[(2-hydroxy-2-pyrimidin-2-ylethyl)amino]-N,2-dimethylbutanamide Traditional Name: 2-chroman-6-yl-3-[[2-hydroxy-2-(2-pyrimidyl)ethyl]amino]-N,2-dimethyl-butyramide Formula: C21H28N4O3 MolecularWeight: 384.47202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C1=CC2=C(C=C1)OCCC2)C(=O)NC)NCC(C3=NC=CC=N3)O

Isomeric SMILES

CC(C(C)(C1=CC2=C(C=C1)OCCC2)C(=O)NC)NCC(C3=NC=CC=N3)O

InChI

InChI=1S/C21H28N4O3/c1-14(25-13-17(26)19-23-9-5-10-24-19)21(2,20(27)22-3)16-7-8-18-15(12-16)6-4-11-28-18/h5,7-10,12,14,17,25-26H,4,6,11,13H2,1-3H3,(H,22,27)