N-(4-morpholin-4-ylphenyl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(4-morpholin-4-ylphenyl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-morpholinophenyl)propanamide CAS Name: N-[4-(4-morpholinyl)phenyl]-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-morpholin-4-ylphenyl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-(4-morpholinophenyl)propionamide Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=NN=C(N3CC=C)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=NN=C(N3CC=C)C4=CC=CC=C4

InChI

InChI=1S/C24H27N5O2S/c1-3-13-29-22(19-7-5-4-6-8-19)26-27-24(29)32-18(2)23(30)25-20-9-11-21(12-10-20)28-14-16-31-17-15-28/h3-12,18H,1,13-17H2,2H3,(H,25,30)