N-(2-cyanoethyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2-cyanoethyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]acetamide Formula: C18H21N5O2S MolecularWeight: 371.45664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=NC3=CC=CC=C3C(=N2)SCC(=O)NCCC#N

Isomeric SMILES

C1COCCN1CC2=NC3=CC=CC=C3C(=N2)SCC(=O)NCCC#N

InChI

InChI=1S/C18H21N5O2S/c19-6-3-7-20-17(24)13-26-18-14-4-1-2-5-15(14)21-16(22-18)12-23-8-10-25-11-9-23/h1-2,4-5H,3,7-13H2,(H,20,24)