1-[5-[(3-bromophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[5-[(3-bromophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea Openeye Name: 1-[5-[(3-bromophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea CAS Name: 1-[5-[(3-bromophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[5-[(3-bromophenyl)methyl]-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea Traditional Name: 1-[5-(3-bromobenzyl)-1,3,4-thiadiazol-2-yl]-3-(4-methoxyphenyl)urea Formula: C17H15BrN4O2S MolecularWeight: 419.2956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CC3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H15BrN4O2S/c1-24-14-7-5-13(6-8-14)19-16(23)20-17-22-21-15(25-17)10-11-3-2-4-12(18)9-11/h2-9H,10H2,1H3,(H2,19,20,22,23)