3-[(3-chloranyl-1-benzothiophen-2-yl)methylsulfanyl]-5-propyl-1H-1,2,4-triazole

Systemtic Name: 3-[(3-chloranyl-1-benzothiophen-2-yl)methylsulfanyl]-5-propyl-1H-1,2,4-triazole Openeye Name: 3-[(3-chlorobenzothiophen-2-yl)methylsulfanyl]-5-propyl-1H-1,2,4-triazole CAS Name: 3-[(3-chloro-1-benzothiophen-2-yl)methylthio]-5-propyl-1H-1,2,4-triazole IUPAC Name: 3-[(3-chloro-1-benzothiophen-2-yl)methylsulfanyl]-5-propyl-1H-1,2,4-triazole Traditional Name: 3-[(3-chlorobenzothiophen-2-yl)methylthio]-5-propyl-1H-1,2,4-triazole Formula: C14H14ClN3S2 MolecularWeight: 323.86406

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CCCC1=NC(=NN1)SCC2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C14H14ClN3S2/c1-2-5-12-16-14(18-17-12)19-8-11-13(15)9-6-3-4-7-10(9)20-11/h3-4,6-7H,2,5,8H2,1H3,(H,16,17,18)