2-[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]-1-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone

Systemtic Name: 2-[5-(4-bromophenyl)-1,2,3,4-tetrazol-2-yl]-1-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone Openeye Name: 2-[5-(4-bromophenyl)tetrazol-2-yl]-1-[2-(2-thienyl)pyrrolidin-1-yl]ethanone CAS Name: 2-[5-(4-bromophenyl)-2-tetrazolyl]-1-(2-thiophen-2-yl-1-pyrrolidinyl)ethanone IUPAC Name: 2-[5-(4-bromophenyl)tetrazol-2-yl]-1-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone Traditional Name: 2-[5-(4-bromophenyl)tetrazol-2-yl]-1-[2-(2-thienyl)pyrrolidino]ethanone Formula: C17H16BrN5OS MolecularWeight: 418.31084

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CN2N=C(N=N2)C3=CC=C(C=C3)Br)C4=CC=CS4

Isomeric SMILES

C1CC(N(C1)C(=O)CN2N=C(N=N2)C3=CC=C(C=C3)Br)C4=CC=CS4

InChI

InChI=1S/C17H16BrN5OS/c18-13-7-5-12(6-8-13)17-19-21-23(20-17)11-16(24)22-9-1-3-14(22)15-4-2-10-25-15/h2,4-8,10,14H,1,3,9,11H2