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

Systemtic Name: N,N-bis(2-cyanoethyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N,N-bis(2-cyanoethyl)-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N,N-bis(2-cyanoethyl)-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N,N-bis(2-cyanoethyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N,N-bis(2-cyanoethyl)-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]acetamide Formula: C21H24N6O2S MolecularWeight: 424.51926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N6O2S/c22-7-3-9-27(10-4-8-23)20(28)16-30-21-17-5-1-2-6-18(17)24-19(25-21)15-26-11-13-29-14-12-26/h1-2,5-6H,3-4,9-16H2