N-(4-morpholin-4-ylcarbonylphenyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-morpholin-4-ylcarbonylphenyl)-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(morpholine-4-carbonyl)phenyl]acetamide CAS Name: N-[4-[4-morpholinyl(oxo)methyl]phenyl]-2-[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-[4-(morpholine-4-carbonyl)phenyl]-2-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[4-(morpholine-4-carbonyl)phenyl]acetamide Formula: C23H24N6O3S MolecularWeight: 464.54006

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N3CCOCC3)C4=CN=CC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N3CCOCC3)C4=CN=CC=C4

InChI

InChI=1S/C23H24N6O3S/c1-2-10-29-21(18-4-3-9-24-15-18)26-27-23(29)33-16-20(30)25-19-7-5-17(6-8-19)22(31)28-11-13-32-14-12-28/h2-9,15H,1,10-14,16H2,(H,25,30)