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

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylsulfanylpropyl)ethanamide Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylsulfanylpropyl)acetamide CAS Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[3-(phenylthio)propyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylsulfanylpropyl)acetamide Traditional Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[3-(phenylthio)propyl]acetamide Formula: C16H21N5OS2 MolecularWeight: 363.50084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2N)SCC(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

C1CC1C2=NN=C(N2N)SCC(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C16H21N5OS2/c17-21-15(12-7-8-12)19-20-16(21)24-11-14(22)18-9-4-10-23-13-5-2-1-3-6-13/h1-3,5-6,12H,4,7-11,17H2,(H,18,22)