2-[[3-(1,3-dithian-2-yl)phenyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-ethanamide

Systemtic Name: 2-[[3-(1,3-dithian-2-yl)phenyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-ethanamide Openeye Name: 2-[3-(1,3-dithian-2-yl)anilino]-N-(5-methylisoxazol-3-yl)-2-phenyl-acetamide CAS Name: 2-[3-(1,3-dithian-2-yl)anilino]-N-(5-methyl-3-isoxazolyl)-2-phenylacetamide IUPAC Name: 2-[3-(1,3-dithian-2-yl)anilino]-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide Traditional Name: 2-[3-(1,3-dithian-2-yl)anilino]-N-(5-methylisoxazol-3-yl)-2-phenyl-acetamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)NC3=CC=CC(=C3)C4SCCCS4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)NC3=CC=CC(=C3)C4SCCCS4

InChI

InChI=1S/C22H23N3O2S2/c1-15-13-19(25-27-15)24-21(26)20(16-7-3-2-4-8-16)23-18-10-5-9-17(14-18)22-28-11-6-12-29-22/h2-5,7-10,13-14,20,22-23H,6,11-12H2,1H3,(H,24,25,26)