3-bromanyl-N-[2-[5-(3,3-diphenylpropanoylamino)-1,3,4-thiadiazol-2-yl]ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-[5-(3,3-diphenylpropanoylamino)-1,3,4-thiadiazol-2-yl]ethyl]benzamide Openeye Name: 3-bromo-N-[2-[5-(3,3-diphenylpropanoylamino)-1,3,4-thiadiazol-2-yl]ethyl]benzamide CAS Name: 3-bromo-N-[2-[5-[(1-oxo-3,3-diphenylpropyl)amino]-1,3,4-thiadiazol-2-yl]ethyl]benzamide IUPAC Name: 3-bromo-N-[2-[5-(3,3-diphenylpropanoylamino)-1,3,4-thiadiazol-2-yl]ethyl]benzamide Traditional Name: 3-bromo-N-[2-[5-(3,3-diphenylpropanoylamino)-1,3,4-thiadiazol-2-yl]ethyl]benzamide Formula: C26H23BrN4O2S MolecularWeight: 535.45542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)NC2=NN=C(S2)CCNC(=O)C3=CC(=CC=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)NC2=NN=C(S2)CCNC(=O)C3=CC(=CC=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C26H23BrN4O2S/c27-21-13-7-12-20(16-21)25(33)28-15-14-24-30-31-26(34-24)29-23(32)17-22(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-13,16,22H,14-15,17H2,(H,28,33)(H,29,31,32)