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

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C23H17N5OS MolecularWeight: 411.47898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)CN5C=NC=N5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)CN5C=NC=N5

InChI

InChI=1S/C23H17N5OS/c29-22(17-7-5-16(6-8-17)13-28-15-24-14-25-28)26-19-11-9-18(10-12-19)23-27-20-3-1-2-4-21(20)30-23/h1-12,14-15H,13H2,(H,26,29)