2-[[4-ethyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4aH-quinazolin-4-one

Systemtic Name: 2-[[4-ethyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4aH-quinazolin-4-one Openeye Name: 2-[[4-ethyl-5-(morpholinomethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4aH-quinazolin-4-one CAS Name: 2-[[[4-ethyl-5-(4-morpholinylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-4aH-quinazolin-4-one IUPAC Name: 2-[[4-ethyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-4aH-quinazolin-4-one Traditional Name: 2-[[[4-ethyl-5-(morpholinomethyl)-1,2,4-triazol-3-yl]thio]methyl]-4aH-quinazolin-4-one Formula: C18H22N6O2S MolecularWeight: 386.47128

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=NC(=O)C3C=CC=CC3=N2)CN4CCOCC4

Isomeric SMILES

CCN1C(=NN=C1SCC2=NC(=O)C3C=CC=CC3=N2)CN4CCOCC4

InChI

InChI=1S/C18H22N6O2S/c1-2-24-16(11-23-7-9-26-10-8-23)21-22-18(24)27-12-15-19-14-6-4-3-5-13(14)17(25)20-15/h3-6,13H,2,7-12H2,1H3