2,2-dimethyl-N-[6-methyl-4-oxidanylidene-5-(pyridin-4-ylsulfanylmethyl)-1,7-dihydropyrrolo[2,3-d]pyrimidin-2-yl]propanamide

Systemtic Name: 2,2-dimethyl-N-[6-methyl-4-oxidanylidene-5-(pyridin-4-ylsulfanylmethyl)-1,7-dihydropyrrolo[2,3-d]pyrimidin-2-yl]propanamide Openeye Name: 2,2-dimethyl-N-[6-methyl-4-oxo-5-(4-pyridylsulfanylmethyl)-1,7-dihydropyrrolo[2,3-d]pyrimidin-2-yl]propanamide CAS Name: 2,2-dimethyl-N-[6-methyl-4-oxo-5-[(pyridin-4-ylthio)methyl]-1,7-dihydropyrrolo[2,3-d]pyrimidin-2-yl]propanamide IUPAC Name: 2,2-dimethyl-N-[6-methyl-4-oxo-5-(pyridin-4-ylsulfanylmethyl)-1,7-dihydropyrrolo[2,3-d]pyrimidin-2-yl]propanamide Traditional Name: N-[4-keto-6-methyl-5-[(4-pyridylthio)methyl]-1,7-dihydropyrrolo[2,3-d]pyrimidin-2-yl]-2,2-dimethyl-propionamide Formula: C18H21N5O2S MolecularWeight: 371.45664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)NC(=NC2=O)NC(=O)C(C)(C)C)CSC3=CC=NC=C3

Isomeric SMILES

CC1=C(C2=C(N1)NC(=NC2=O)NC(=O)C(C)(C)C)CSC3=CC=NC=C3

InChI

InChI=1S/C18H21N5O2S/c1-10-12(9-26-11-5-7-19-8-6-11)13-14(20-10)21-17(22-15(13)24)23-16(25)18(2,3)4/h5-8H,9H2,1-4H3,(H3,20,21,22,23,24,25)