4-azanyl-2-[1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[2-(3,4-dihydro-2H-quinolin-1-yl)-1-methyl-2-oxo-ethyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxopropan-2-yl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[1-(3,4-dihydro-2H-quinolin-1-yl)-1-oxopropan-2-yl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-1-methyl-ethyl]thio]pyrimidine-5-carbonitrile Formula: C17H17N5OS MolecularWeight: 339.41478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC2=CC=CC=C21)SC3=NC=C(C(=N3)N)C#N

Isomeric SMILES

CC(C(=O)N1CCCC2=CC=CC=C21)SC3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C17H17N5OS/c1-11(24-17-20-10-13(9-18)15(19)21-17)16(23)22-8-4-6-12-5-2-3-7-14(12)22/h2-3,5,7,10-11H,4,6,8H2,1H3,(H2,19,20,21)