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

Systemtic Name: 4-cyano-N-[5-[(3,4-dichlorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-cyano-N-[5-[(3,4-dichlorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-cyano-N-[5-[(3,4-dichlorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-cyano-N-[5-[(3,4-dichlorophenyl)methylamino]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-cyano-N-[5-[(3,4-dichlorobenzyl)amino]-1,3,4-thiadiazol-2-yl]benzamide Formula: C17H11Cl2N5OS MolecularWeight: 404.27314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)NC2=NN=C(S2)NCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)NC2=NN=C(S2)NCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H11Cl2N5OS/c18-13-6-3-11(7-14(13)19)9-21-16-23-24-17(26-16)22-15(25)12-4-1-10(8-20)2-5-12/h1-7H,9H2,(H,21,23)(H,22,24,25)