2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(dimethylamino)propyl]ethanamide

Systemtic Name: 2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(dimethylamino)propyl]ethanamide Openeye Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(dimethylamino)propyl]acetamide CAS Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-[3-(dimethylamino)propyl]acetamide IUPAC Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(dimethylamino)propyl]acetamide Traditional Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-[3-(dimethylamino)propyl]acetamide Formula: C13H26N6OS MolecularWeight: 314.45014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1N)SCC(=O)NCCCN(C)C

Isomeric SMILES

CCCCC1=NN=C(N1N)SCC(=O)NCCCN(C)C

InChI

InChI=1S/C13H26N6OS/c1-4-5-7-11-16-17-13(19(11)14)21-10-12(20)15-8-6-9-18(2)3/h4-10,14H2,1-3H3,(H,15,20)