4-(1-hydroxyethyloxy)-2-piperazin-1-yl-6-thiomorpholin-4-yl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(1-hydroxyethyloxy)-2-piperazin-1-yl-6-thiomorpholin-4-yl-pyrimidine-5-carbonitrile Openeye Name: 4-(1-hydroxyethoxy)-2-piperazin-1-yl-6-thiomorpholino-pyrimidine-5-carbonitrile CAS Name: 4-(1-hydroxyethoxy)-2-(1-piperazinyl)-6-thiomorpholin-4-yl-5-pyrimidinecarbonitrile IUPAC Name: 4-(1-hydroxyethoxy)-2-piperazin-1-yl-6-thiomorpholin-4-ylpyrimidine-5-carbonitrile Traditional Name: 4-(1-hydroxyethoxy)-2-piperazino-6-thiomorpholino-pyrimidine-5-carbonitrile Formula: C15H22N6O2S MolecularWeight: 350.43918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(O)OC1=NC(=NC(=C1C#N)N2CCSCC2)N3CCNCC3

Isomeric SMILES

CC(O)OC1=NC(=NC(=C1C#N)N2CCSCC2)N3CCNCC3

InChI

InChI=1S/C15H22N6O2S/c1-11(22)23-14-12(10-16)13(20-6-8-24-9-7-20)18-15(19-14)21-4-2-17-3-5-21/h11,17,22H,2-9H2,1H3