7-chloranyl-2-[[4-(3-ethylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[4-(3-ethylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[4-(3-ethylphenyl)-5-morpholino-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[[4-(3-ethylphenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[4-(3-ethylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[[4-(3-ethylphenyl)-5-morpholino-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one Formula: C23H23ClN6O2S MolecularWeight: 482.98572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)N2C(=NN=C2SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl)N5CCOCC5

Isomeric SMILES

CCC1=CC(=CC=C1)N2C(=NN=C2SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl)N5CCOCC5

InChI

InChI=1S/C23H23ClN6O2S/c1-2-15-4-3-5-17(12-15)30-22(29-8-10-32-11-9-29)27-28-23(30)33-14-20-25-19-13-16(24)6-7-18(19)21(31)26-20/h3-7,12-13H,2,8-11,14H2,1H3,(H,25,26,31)