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

Systemtic Name: 4-cyano-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-cyano-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-cyano-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-cyano-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-cyano-N-[5-(3,3-diphenylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C25H21N5OS MolecularWeight: 439.53214

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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)C#N)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C25H21N5OS/c26-17-18-11-13-21(14-12-18)23(31)28-25-30-29-24(32-25)27-16-15-22(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-14,22H,15-16H2,(H,27,29)(H,28,30,31)