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

Systemtic Name: N-(4-morpholin-4-ylphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(4-morpholinophenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-[4-(4-morpholinyl)phenyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-morpholin-4-ylphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-morpholinophenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=NN(C=N3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=NN(C=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N5O2S/c1-16(29-21-22-15-26(24-21)19-5-3-2-4-6-19)20(27)23-17-7-9-18(10-8-17)25-11-13-28-14-12-25/h2-10,15-16H,11-14H2,1H3,(H,23,27)