2-[(4-azanyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[(4-amino-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylpropyl)acetamide CAS Name: 2-[(4-amino-5-propan-2-yl-1,2,4-triazol-3-yl)thio]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[(4-amino-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylpropyl)acetamide Traditional Name: 2-[(4-amino-5-isopropyl-1,2,4-triazol-3-yl)thio]-N-(3-phenylpropyl)acetamide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1N)SCC(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)C1=NN=C(N1N)SCC(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C16H23N5OS/c1-12(2)15-19-20-16(21(15)17)23-11-14(22)18-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,12H,6,9-11,17H2,1-2H3,(H,18,22)