N-aminocarbonyl-3-[[4-(4-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-aminocarbonyl-3-[[4-(4-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-carbamoyl-3-[[5-morpholino-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-carbamoyl-3-[[4-(4-methylphenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-carbamoyl-3-[[4-(4-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-carbamoyl-3-[[5-morpholino-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C17H22N6O3S MolecularWeight: 390.45998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)NC(=O)N)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)NC(=O)N)N3CCOCC3

InChI

InChI=1S/C17H22N6O3S/c1-12-2-4-13(5-3-12)23-16(22-7-9-26-10-8-22)20-21-17(23)27-11-6-14(24)19-15(18)25/h2-5H,6-11H2,1H3,(H3,18,19,24,25)