2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholin-4-yl-2-phenyl-ethanone

Systemtic Name: 2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholin-4-yl-2-phenyl-ethanone Openeye Name: 2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-morpholino-2-phenyl-ethanone CAS Name: 2-[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-(4-morpholinyl)-2-phenylethanone IUPAC Name: 2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-morpholin-4-yl-2-phenylethanone Traditional Name: 2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-1-morpholino-2-phenyl-ethanone Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SC(C3=CC=CC=C3)C(=O)N4CCOCC4)C5=CN=CC=C5

Isomeric SMILES

C1CC1N2C(=NN=C2SC(C3=CC=CC=C3)C(=O)N4CCOCC4)C5=CN=CC=C5

InChI

InChI=1S/C22H23N5O2S/c28-21(26-11-13-29-14-12-26)19(16-5-2-1-3-6-16)30-22-25-24-20(27(22)18-8-9-18)17-7-4-10-23-15-17/h1-7,10,15,18-19H,8-9,11-14H2