2-[(4-cyclopropyl-5-piperidin-1-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-piperidin-1-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-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone CAS Name: 2-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-1-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone IUPAC Name: 2-[(4-cyclopropyl-5-piperidin-1-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-piperidino-1,2,4-triazol-3-yl)thio]-1-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone Formula: C22H29N5O2S MolecularWeight: 427.56296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(CCC2)C(=O)CSC3=NN=C(N3C4CC4)N5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)N(CCC2)C(=O)CSC3=NN=C(N3C4CC4)N5CCCCC5

InChI

InChI=1S/C22H29N5O2S/c1-29-18-9-10-19-16(14-18)6-5-13-26(19)20(28)15-30-22-24-23-21(27(22)17-7-8-17)25-11-3-2-4-12-25/h9-10,14,17H,2-8,11-13,15H2,1H3