N-(3,4-dihydro-2H-thiochromen-4-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzamide Openeye Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-N-thiochroman-4-yl-benzamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]benzamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzamide Traditional Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]-N-thiochroman-4-yl-benzamide Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)CSC2=CC=CC=C2C(=O)NC3CCSC4=CC=CC=C34

Isomeric SMILES

CC1=NOC(=N1)CSC2=CC=CC=C2C(=O)NC3CCSC4=CC=CC=C34

InChI

InChI=1S/C20H19N3O2S2/c1-13-21-19(25-23-13)12-27-18-9-5-3-7-15(18)20(24)22-16-10-11-26-17-8-4-2-6-14(16)17/h2-9,16H,10-12H2,1H3,(H,22,24)