2-[(2-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-4-chloranyl-1,3-benzothiazole

Systemtic Name: 2-[(2-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-4-chloranyl-1,3-benzothiazole Openeye Name: 2-(2-butyltetrazol-5-yl)sulfanyl-4-chloro-1,3-benzothiazole CAS Name: 2-[(2-butyl-5-tetrazolyl)thio]-4-chloro-1,3-benzothiazole IUPAC Name: 2-(2-butyltetrazol-5-yl)sulfanyl-4-chloro-1,3-benzothiazole Traditional Name: 2-[(2-butyltetrazol-5-yl)thio]-4-chloro-1,3-benzothiazole Formula: C12H12ClN5S2 MolecularWeight: 325.84018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1N=C(N=N1)SC2=NC3=C(S2)C=CC=C3Cl

Isomeric SMILES

CCCCN1N=C(N=N1)SC2=NC3=C(S2)C=CC=C3Cl

InChI

InChI=1S/C12H12ClN5S2/c1-2-3-7-18-16-11(15-17-18)20-12-14-10-8(13)5-4-6-9(10)19-12/h4-6H,2-3,7H2,1H3