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

Systemtic Name: 4-bromanyl-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-bromo-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-bromo-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-bromo-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-bromo-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C24H21BrN4OS MolecularWeight: 493.41874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C24H21BrN4OS/c25-20-13-11-19(12-14-20)22(30)27-24-29-28-23(31-24)26-16-15-21(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14,21H,15-16H2,(H,26,28)(H,27,29,30)