2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylpropyl)acetamide CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylpropyl)acetamide Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-(3-phenylpropyl)acetamide Formula: C13H17N5OS MolecularWeight: 291.37198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)CSC2=NN=CN2N

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)CSC2=NN=CN2N

InChI

InChI=1S/C13H17N5OS/c14-18-10-16-17-13(18)20-9-12(19)15-8-4-7-11-5-2-1-3-6-11/h1-3,5-6,10H,4,7-9,14H2,(H,15,19)