4-[5-[(2-chloranyl-7-methoxy-quinolin-3-yl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine

Systemtic Name: 4-[5-[(2-chloranyl-7-methoxy-quinolin-3-yl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine Openeye Name: 4-[5-[(2-chloro-7-methoxy-3-quinolyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine CAS Name: 4-[5-[(2-chloro-7-methoxy-3-quinolinyl)methylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine IUPAC Name: 4-[5-[(2-chloro-7-methoxyquinolin-3-yl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine Traditional Name: 4-[5-[(2-chloro-7-methoxy-3-quinolyl)methylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]morpholine Formula: C20H22ClN5O2S MolecularWeight: 431.93898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)CSC3=NN=C(N3C4CC4)N5CCOCC5)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)CSC3=NN=C(N3C4CC4)N5CCOCC5)Cl

InChI

InChI=1S/C20H22ClN5O2S/c1-27-16-5-2-13-10-14(18(21)22-17(13)11-16)12-29-20-24-23-19(26(20)15-3-4-15)25-6-8-28-9-7-25/h2,5,10-11,15H,3-4,6-9,12H2,1H3