5-(1-benzothiophen-3-yl)-4-propyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(1-benzothiophen-3-yl)-4-propyl-1,2,4-triazole-3-thiolate Openeye Name: 5-(benzothiophen-3-yl)-4-propyl-1,2,4-triazole-3-thiolate CAS Name: 5-(1-benzothiophen-3-yl)-4-propyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-(1-benzothiophen-3-yl)-4-propyl-1,2,4-triazole-3-thiolate Traditional Name: 5-(benzothiophen-3-yl)-4-propyl-1,2,4-triazole-3-thiolate Formula: C13H12N3S2- MolecularWeight: 274.38448

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1[S-])C2=CSC3=CC=CC=C32

Isomeric SMILES

CCCN1C(=NN=C1[S-])C2=CSC3=CC=CC=C32

InChI

InChI=1S/C13H13N3S2/c1-2-7-16-12(14-15-13(16)17)10-8-18-11-6-4-3-5-9(10)11/h3-6,8H,2,7H2,1H3,(H,15,17)/p-1