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

Systemtic Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(naphthalen-1-ylcarbamoylamino)pentanamide Openeye Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(1-naphthylcarbamoylamino)pentanamide CAS Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[[(1-naphthalenylamino)-oxomethyl]amino]pentanamide IUPAC Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(naphthalen-1-ylcarbamoylamino)pentanamide Traditional Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(1-naphthylcarbamoylamino)valeramide Formula: C25H24BrN5O2S MolecularWeight: 538.45936

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)Br)NC(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)Br)NC(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H24BrN5O2S/c1-3-15(2)21(28-24(33)27-20-13-7-9-16-8-4-5-12-19(16)20)22(32)29-25-31-30-23(34-25)17-10-6-11-18(26)14-17/h4-15,21H,3H2,1-2H3,(H2,27,28,33)(H,29,31,32)