2-[(4-cyclopropyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone

Systemtic Name: 2-[(4-cyclopropyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone Openeye Name: 2-[(4-cyclopropyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]-1-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone CAS Name: 2-[[4-cyclopropyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-1-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone IUPAC Name: 2-[(4-cyclopropyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone Traditional Name: 2-[(4-cyclopropyl-5-morpholino-1,2,4-triazol-3-yl)thio]-1-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone Formula: C21H27N5O3S MolecularWeight: 429.53578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(CCC2)C(=O)CSC3=NN=C(N3C4CC4)N5CCOCC5

Isomeric SMILES

COC1=CC2=C(C=C1)N(CCC2)C(=O)CSC3=NN=C(N3C4CC4)N5CCOCC5

InChI

InChI=1S/C21H27N5O3S/c1-28-17-6-7-18-15(13-17)3-2-8-25(18)19(27)14-30-21-23-22-20(26(21)16-4-5-16)24-9-11-29-12-10-24/h6-7,13,16H,2-5,8-12,14H2,1H3