N-[(2S)-3-methylbutan-2-yl]-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-[(2S)-3-methylbutan-2-yl]-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-[(1S)-1,2-dimethylpropyl]-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-[(2S)-3-methylbutan-2-yl]-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-[(2S)-3-methylbutan-2-yl]-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-[(1S)-1,2-dimethylpropyl]-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]acetamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CSC1=NC(=NC2=CC=CC=C21)CN3CCOCC3

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)CSC1=NC(=NC2=CC=CC=C21)CN3CCOCC3

InChI

InChI=1S/C20H28N4O2S/c1-14(2)15(3)21-19(25)13-27-20-16-6-4-5-7-17(16)22-18(23-20)12-24-8-10-26-11-9-24/h4-7,14-15H,8-13H2,1-3H3,(H,21,25)/t15-/m0/s1