3-(benzotriazol-1-yl)-N-[5-[(4-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-(benzotriazol-1-yl)-N-[5-[(4-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 3-(benzotriazol-1-yl)-N-[5-[(4-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-(1-benzotriazolyl)-N-[5-[(4-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-(benzotriazol-1-yl)-N-[5-[(4-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 3-(benzotriazol-1-yl)-N-[5-(4-fluorobenzyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C18H15FN6OS MolecularWeight: 382.414703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CCC(=O)NC3=NN=C(S3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CCC(=O)NC3=NN=C(S3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C18H15FN6OS/c19-13-7-5-12(6-8-13)11-17-22-23-18(27-17)20-16(26)9-10-25-15-4-2-1-3-14(15)21-24-25/h1-8H,9-11H2,(H,20,23,26)