4-(1,3-dithian-2-yl)-N-(2-phenylpyrimidin-5-yl)benzamide

Systemtic Name: 4-(1,3-dithian-2-yl)-N-(2-phenylpyrimidin-5-yl)benzamide Openeye Name: 4-(1,3-dithian-2-yl)-N-(2-phenylpyrimidin-5-yl)benzamide CAS Name: 4-(1,3-dithian-2-yl)-N-(2-phenyl-5-pyrimidinyl)benzamide IUPAC Name: 4-(1,3-dithian-2-yl)-N-(2-phenylpyrimidin-5-yl)benzamide Traditional Name: 4-(1,3-dithian-2-yl)-N-(2-phenylpyrimidin-5-yl)benzamide Formula: C21H19N3OS2 MolecularWeight: 393.52506

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)C(=O)NC3=CN=C(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)C(=O)NC3=CN=C(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3OS2/c25-20(16-7-9-17(10-8-16)21-26-11-4-12-27-21)24-18-13-22-19(23-14-18)15-5-2-1-3-6-15/h1-3,5-10,13-14,21H,4,11-12H2,(H,24,25)