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

Systemtic Name: N-aminocarbonyl-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-carbamoyl-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-carbamoyl-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-carbamoyl-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-carbamoyl-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C13H15N5O3S MolecularWeight: 321.3549

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NNC(=N1)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=NNC(=N1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C13H15N5O3S/c1-7(11(19)16-12(14)20)22-13-15-10(17-18-13)8-3-5-9(21-2)6-4-8/h3-7H,1-2H3,(H,15,17,18)(H3,14,16,19,20)