N-aminocarbonyl-2-[[5-(4-tert-butylphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-aminocarbonyl-2-[[5-(4-tert-butylphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[5-(4-tert-butylphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoyl-propanamide CAS Name: 2-[[5-(4-tert-butylphenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-carbamoylpropanamide IUPAC Name: 2-[[5-(4-tert-butylphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoylpropanamide Traditional Name: 2-[[5-(4-tert-butylphenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-carbamoyl-propionamide Formula: C18H25N5O2S MolecularWeight: 375.4884

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NC(=O)N)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCN1C(=NN=C1SC(C)C(=O)NC(=O)N)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C18H25N5O2S/c1-6-23-14(12-7-9-13(10-8-12)18(3,4)5)21-22-17(23)26-11(2)15(24)20-16(19)25/h7-11H,6H2,1-5H3,(H3,19,20,24,25)