2-[(3-bromanyl-4-propoxy-phenyl)methyl]-5-(phenylmethyl)-1,3,4-thiadiazole

Systemtic Name: 2-[(3-bromanyl-4-propoxy-phenyl)methyl]-5-(phenylmethyl)-1,3,4-thiadiazole Openeye Name: 2-benzyl-5-[(3-bromo-4-propoxy-phenyl)methyl]-1,3,4-thiadiazole CAS Name: 2-[(3-bromo-4-propoxyphenyl)methyl]-5-(phenylmethyl)-1,3,4-thiadiazole IUPAC Name: 2-benzyl-5-[(3-bromo-4-propoxyphenyl)methyl]-1,3,4-thiadiazole Traditional Name: 2-benzyl-5-(3-bromo-4-propoxy-benzyl)-1,3,4-thiadiazole Formula: C19H19BrN2OS MolecularWeight: 403.33596

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CC2=NN=C(S2)CC3=CC=CC=C3)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CC2=NN=C(S2)CC3=CC=CC=C3)Br

InChI

InChI=1S/C19H19BrN2OS/c1-2-10-23-17-9-8-15(11-16(17)20)13-19-22-21-18(24-19)12-14-6-4-3-5-7-14/h3-9,11H,2,10,12-13H2,1H3