1-[2-[[4-azanyl-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]pyrrolidin-2-one

Systemtic Name: 1-[2-[[4-azanyl-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]pyrrolidin-2-one Openeye Name: 1-[2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]pyrrolidin-2-one CAS Name: 1-[2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-2-pyrrolidinone IUPAC Name: 1-[2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]pyrrolidin-2-one Traditional Name: 1-[2-[[4-amino-5-(3-bromophenyl)-1,2,4-triazol-3-yl]thio]acetyl]-2-pyrrolidone Formula: C14H14BrN5O2S MolecularWeight: 396.26226

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CC(=O)N(C1)C(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)Br

InChI

InChI=1S/C14H14BrN5O2S/c15-10-4-1-3-9(7-10)13-17-18-14(20(13)16)23-8-12(22)19-6-2-5-11(19)21/h1,3-4,7H,2,5-6,8,16H2