4-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-thiophen-2-yl-butan-1-one Openeye Name: 4-(1-cyclopentyltetrazol-5-yl)sulfanyl-1-(2-thienyl)butan-1-one CAS Name: 4-[(1-cyclopentyl-5-tetrazolyl)thio]-1-thiophen-2-yl-1-butanone IUPAC Name: 4-(1-cyclopentyltetrazol-5-yl)sulfanyl-1-thiophen-2-ylbutan-1-one Traditional Name: 4-[(1-cyclopentyltetrazol-5-yl)thio]-1-(2-thienyl)butan-1-one Formula: C14H18N4OS2 MolecularWeight: 322.44892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN=N2)SCCCC(=O)C3=CC=CS3

Isomeric SMILES

C1CCC(C1)N2C(=NN=N2)SCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C14H18N4OS2/c19-12(13-8-4-9-20-13)7-3-10-21-14-15-16-17-18(14)11-5-1-2-6-11/h4,8-9,11H,1-3,5-7,10H2