N-(2,1,3-benzoxadiazol-4-yl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(2,1,3-benzoxadiazol-4-yl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide Openeye Name: N-(2,1,3-benzoxadiazol-4-yl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide CAS Name: N-(2,1,3-benzoxadiazol-4-yl)-4-(3,4-dichlorophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2,1,3-benzoxadiazol-4-yl)-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide Traditional Name: N-benzofurazan-4-yl-4-(3,4-dichlorophenyl)piperazine-1-carbothioamide Formula: C17H15Cl2N5OS MolecularWeight: 408.3049

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)Cl)Cl)C(=S)NC3=CC=CC4=NON=C43

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)Cl)Cl)C(=S)NC3=CC=CC4=NON=C43

InChI

InChI=1S/C17H15Cl2N5OS/c18-12-5-4-11(10-13(12)19)23-6-8-24(9-7-23)17(26)20-14-2-1-3-15-16(14)22-25-21-15/h1-5,10H,6-9H2,(H,20,26)