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

Systemtic Name: N-aminocarbonyl-2-[[4-(3-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-carbamoyl-2-[[5-morpholino-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-carbamoyl-2-[[4-(3-methylphenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-carbamoyl-2-[[4-(3-methylphenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-carbamoyl-2-[[5-morpholino-4-(m-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(=CC=C1)N2C(=NN=C2SC(C)C(=O)NC(=O)N)N3CCOCC3

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SC(C)C(=O)NC(=O)N)N3CCOCC3

InChI

InChI=1S/C17H22N6O3S/c1-11-4-3-5-13(10-11)23-16(22-6-8-26-9-7-22)20-21-17(23)27-12(2)14(24)19-15(18)25/h3-5,10,12H,6-9H2,1-2H3,(H3,18,19,24,25)