(2R,3S)-2-azanyl-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide

Systemtic Name: (2R,3S)-2-azanyl-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide Openeye Name: (2R,3S)-2-amino-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide CAS Name: (2R,3S)-2-amino-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methylpentanamide IUPAC Name: (2R,3S)-2-amino-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methylpentanamide Traditional Name: (2R,3S)-2-amino-N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-valeramide Formula: C14H17BrN4OS MolecularWeight: 369.27998

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br)N

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br)N

InChI

InChI=1S/C14H17BrN4OS/c1-3-8(2)11(16)12(20)17-14-19-18-13(21-14)9-4-6-10(15)7-5-9/h4-8,11H,3,16H2,1-2H3,(H,17,19,20)/t8-,11+/m0/s1