2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-butan-2-ylphenyl)propanamide

Systemtic Name: 2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-butan-2-ylphenyl)propanamide Openeye Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-sec-butylphenyl)propanamide CAS Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]-N-(4-butan-2-ylphenyl)propanamide IUPAC Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-butan-2-ylphenyl)propanamide Traditional Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]-N-(4-sec-butylphenyl)propionamide Formula: C19H29N5OS MolecularWeight: 375.53146

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C(C)SC2=NN=C(N2N)C(C)(C)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C(C)SC2=NN=C(N2N)C(C)(C)C

InChI

InChI=1S/C19H29N5OS/c1-7-12(2)14-8-10-15(11-9-14)21-16(25)13(3)26-18-23-22-17(24(18)20)19(4,5)6/h8-13H,7,20H2,1-6H3,(H,21,25)