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

Systemtic Name: 1-(azepan-1-yl)-2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one Openeye Name: 1-(azepan-1-yl)-2-(1-cyclopropyltetrazol-5-yl)sulfanyl-propan-1-one CAS Name: 1-(1-azepanyl)-2-[(1-cyclopropyl-5-tetrazolyl)thio]-1-propanone IUPAC Name: 1-(azepan-1-yl)-2-(1-cyclopropyltetrazol-5-yl)sulfanylpropan-1-one Traditional Name: 1-(azepan-1-yl)-2-[(1-cyclopropyltetrazol-5-yl)thio]propan-1-one Formula: C13H21N5OS MolecularWeight: 295.40374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)SC2=NN=NN2C3CC3

Isomeric SMILES

CC(C(=O)N1CCCCCC1)SC2=NN=NN2C3CC3

InChI

InChI=1S/C13H21N5OS/c1-10(12(19)17-8-4-2-3-5-9-17)20-13-14-15-16-18(13)11-6-7-11/h10-11H,2-9H2,1H3