5-(1-benzothiophen-3-yl)-4-iodanyl-1-(phenylmethyl)-1,2,3-triazole

Systemtic Name: 5-(1-benzothiophen-3-yl)-4-iodanyl-1-(phenylmethyl)-1,2,3-triazole Openeye Name: 5-(benzothiophen-3-yl)-1-benzyl-4-iodo-triazole CAS Name: 5-(1-benzothiophen-3-yl)-4-iodo-1-(phenylmethyl)triazole IUPAC Name: 5-(1-benzothiophen-3-yl)-1-benzyl-4-iodotriazole Traditional Name: 5-(benzothiophen-3-yl)-1-benzyl-4-iodo-triazole Formula: C17H12IN3S MolecularWeight: 417.26675

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(N=N2)I)C3=CSC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(N=N2)I)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C17H12IN3S/c18-17-16(14-11-22-15-9-5-4-8-13(14)15)21(20-19-17)10-12-6-2-1-3-7-12/h1-9,11H,10H2