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

Systemtic Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(butylcarbamoylamino)-3-methyl-pentanamide Openeye Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(butylcarbamoylamino)-3-methyl-pentanamide CAS Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[[butylamino(oxo)methyl]amino]-3-methylpentanamide IUPAC Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(butylcarbamoylamino)-3-methylpentanamide Traditional Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(butylcarbamoylamino)-3-methyl-valeramide Formula: C19H26BrN5O2S MolecularWeight: 468.41104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(C(C)CC)C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCNC(=O)NC(C(C)CC)C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H26BrN5O2S/c1-4-6-11-21-18(27)22-15(12(3)5-2)16(26)23-19-25-24-17(28-19)13-7-9-14(20)10-8-13/h7-10,12,15H,4-6,11H2,1-3H3,(H2,21,22,27)(H,23,25,26)