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

Systemtic Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(3-phenylpropanoylamino)pentanamide Openeye Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(3-phenylpropanoylamino)pentanamide CAS Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[(1-oxo-3-phenylpropyl)amino]pentanamide IUPAC Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(3-phenylpropanoylamino)pentanamide Traditional Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-2-(hydrocinnamoylamino)-3-methyl-valeramide Formula: C25H31N5O2S MolecularWeight: 465.61094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)N(C)C)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)N(C)C)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H31N5O2S/c1-5-17(2)22(26-21(31)16-11-18-9-7-6-8-10-18)23(32)27-25-29-28-24(33-25)19-12-14-20(15-13-19)30(3)4/h6-10,12-15,17,22H,5,11,16H2,1-4H3,(H,26,31)(H,27,29,32)