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

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butan-1-one Openeye Name: 1-(5-chloro-2-thienyl)-4-(1-methyltetrazol-5-yl)sulfanyl-butan-1-one CAS Name: 1-(5-chloro-2-thiophenyl)-4-[(1-methyl-5-tetrazolyl)thio]-1-butanone IUPAC Name: 1-(5-chlorothiophen-2-yl)-4-(1-methyltetrazol-5-yl)sulfanylbutan-1-one Traditional Name: 1-(5-chloro-2-thienyl)-4-[(1-methyltetrazol-5-yl)thio]butan-1-one Formula: C10H11ClN4OS2 MolecularWeight: 302.80354

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCCCC(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CN1C(=NN=N1)SCCCC(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C10H11ClN4OS2/c1-15-10(12-13-14-15)17-6-2-3-7(16)8-4-5-9(11)18-8/h4-5H,2-3,6H2,1H3