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

Systemtic Name: 2-[(3-butyl-1,2,4-triazol-1-yl)sulfanyl]-4-chloranyl-1,3-benzothiazole Openeye Name: 2-[(3-butyl-1,2,4-triazol-1-yl)sulfanyl]-4-chloro-1,3-benzothiazole CAS Name: 2-[(3-butyl-1,2,4-triazol-1-yl)thio]-4-chloro-1,3-benzothiazole IUPAC Name: 2-[(3-butyl-1,2,4-triazol-1-yl)sulfanyl]-4-chloro-1,3-benzothiazole Traditional Name: 2-[(3-butyl-1,2,4-triazol-1-yl)thio]-4-chloro-1,3-benzothiazole Formula: C13H13ClN4S2 MolecularWeight: 324.85212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(C=N1)SC2=NC3=C(S2)C=CC=C3Cl

Isomeric SMILES

CCCCC1=NN(C=N1)SC2=NC3=C(S2)C=CC=C3Cl

InChI

InChI=1S/C13H13ClN4S2/c1-2-3-7-11-15-8-18(17-11)20-13-16-12-9(14)5-4-6-10(12)19-13/h4-6,8H,2-3,7H2,1H3