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

Systemtic Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(naphthalen-1-ylcarbamoylamino)-3-phenyl-propanamide Openeye Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(1-naphthylcarbamoylamino)-3-phenyl-propanamide CAS Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[[(1-naphthalenylamino)-oxomethyl]amino]-3-phenylpropanamide IUPAC Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(naphthalen-1-ylcarbamoylamino)-3-phenylpropanamide Traditional Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-(1-naphthylcarbamoylamino)-3-phenyl-propionamide Formula: C28H22BrN5O2S MolecularWeight: 572.47558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=NN=C(S2)C3=CC=C(C=C3)Br)NC(=O)NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2=NN=C(S2)C3=CC=C(C=C3)Br)NC(=O)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H22BrN5O2S/c29-21-15-13-20(14-16-21)26-33-34-28(37-26)32-25(35)24(17-18-7-2-1-3-8-18)31-27(36)30-23-12-6-10-19-9-4-5-11-22(19)23/h1-16,24H,17H2,(H2,30,31,36)(H,32,34,35)