2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-morpholinosulfonylphenyl)acetamide CAS Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-[4-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-(4-morpholinosulfonylphenyl)acetamide Formula: C16H22N6O4S2 MolecularWeight: 426.51368

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)N

Isomeric SMILES

CCSC1=NN=C(N1CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)N

InChI

InChI=1S/C16H22N6O4S2/c1-2-27-16-20-19-15(17)22(16)11-14(23)18-12-3-5-13(6-4-12)28(24,25)21-7-9-26-10-8-21/h3-6H,2,7-11H2,1H3,(H2,17,19)(H,18,23)