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

Systemtic Name: 2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-morpholinosulfonylphenyl)propanamide CAS Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-(4-morpholinosulfonylphenyl)propionamide Formula: C17H24N6O4S2 MolecularWeight: 440.54026

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)N

Isomeric SMILES

CCSC1=NN=C(N1C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)N

InChI

InChI=1S/C17H24N6O4S2/c1-3-28-17-21-20-16(18)23(17)12(2)15(24)19-13-4-6-14(7-5-13)29(25,26)22-8-10-27-11-9-22/h4-7,12H,3,8-11H2,1-2H3,(H2,18,20)(H,19,24)