2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-1-(azepan-1-yl)ethanone

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-1-(azepan-1-yl)ethanone Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1-(azepan-1-yl)ethanone CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-1-(1-azepanyl)ethanone IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1-(azepan-1-yl)ethanone Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-1-(azepan-1-yl)ethanone Formula: C10H17N5OS MolecularWeight: 255.33988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NN=CN2N

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NN=CN2N

InChI

InChI=1S/C10H17N5OS/c11-15-8-12-13-10(15)17-7-9(16)14-5-3-1-2-4-6-14/h8H,1-7,11H2