3-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]azepan-2-one

Systemtic Name: 3-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]azepan-2-one Openeye Name: 3-(1-isopropyltetrazol-5-yl)sulfanylazepan-2-one CAS Name: 3-[(1-propan-2-yl-5-tetrazolyl)thio]-2-azepanone IUPAC Name: 3-(1-propan-2-yltetrazol-5-yl)sulfanylazepan-2-one Traditional Name: 3-[(1-isopropyltetrazol-5-yl)thio]azepan-2-one Formula: C10H17N5OS MolecularWeight: 255.33988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=N1)SC2CCCCNC2=O

Isomeric SMILES

CC(C)N1C(=NN=N1)SC2CCCCNC2=O

InChI

InChI=1S/C10H17N5OS/c1-7(2)15-10(12-13-14-15)17-8-5-3-4-6-11-9(8)16/h7-8H,3-6H2,1-2H3,(H,11,16)