N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-1-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-1-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-1-phenyl-triazole-4-carboxamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-1-phenyl-4-triazolecarboxamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-1-phenyltriazole-4-carboxamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-1-phenyl-triazole-4-carboxamide Formula: C19H17ClN6O2 MolecularWeight: 396.83028

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C19H17ClN6O2/c20-15-10-13(6-7-17(15)25-9-8-21-18(27)12-25)22-19(28)16-11-26(24-23-16)14-4-2-1-3-5-14/h1-7,10-11H,8-9,12H2,(H,21,27)(H,22,28)