N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-chloranyl-5-(1,2,4-triazol-4-yl)benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-chloranyl-5-(1,2,4-triazol-4-yl)benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-chloro-5-(1,2,4-triazol-4-yl)benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-chloro-5-(1,2,4-triazol-4-yl)benzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-chloro-5-(1,2,4-triazol-4-yl)benzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-2-chloro-5-(1,2,4-triazol-4-yl)benzamide Formula: C22H14ClN5OS MolecularWeight: 431.89746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)C4=C(C=CC(=C4)N5C=NN=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NC(=O)C4=C(C=CC(=C4)N5C=NN=C5)Cl

InChI

InChI=1S/C22H14ClN5OS/c23-18-9-8-16(28-12-24-25-13-28)11-17(18)21(29)26-15-5-3-4-14(10-15)22-27-19-6-1-2-7-20(19)30-22/h1-13H,(H,26,29)