5-[(3-bromanyl-4-propan-2-yloxy-phenyl)methyl]-N-phenyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(3-bromanyl-4-propan-2-yloxy-phenyl)methyl]-N-phenyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-bromo-4-isopropoxy-phenyl)methyl]-N-phenyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-bromo-4-propan-2-yloxyphenyl)methyl]-N-phenyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-bromo-4-propan-2-yloxyphenyl)methyl]-N-phenyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-(3-bromo-4-isopropoxy-benzyl)-1,3,4-thiadiazol-2-yl]-phenyl-amine Formula: C18H18BrN3OS MolecularWeight: 404.32402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CC2=NN=C(S2)NC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CC2=NN=C(S2)NC3=CC=CC=C3)Br

InChI

InChI=1S/C18H18BrN3OS/c1-12(2)23-16-9-8-13(10-15(16)19)11-17-21-22-18(24-17)20-14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3,(H,20,22)