N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide Openeye Name: N-(6-chlorothiochroman-4-yl)-3-[5-(p-tolyl)oxazol-2-yl]propanamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-[5-(4-methylphenyl)-2-oxazolyl]propanamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide Traditional Name: N-(6-chlorothiochroman-4-yl)-3-[5-(p-tolyl)oxazol-2-yl]propionamide Formula: C22H21ClN2O2S MolecularWeight: 412.93234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN=C(O2)CCC(=O)NC3CCSC4=C3C=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN=C(O2)CCC(=O)NC3CCSC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C22H21ClN2O2S/c1-14-2-4-15(5-3-14)19-13-24-22(27-19)9-8-21(26)25-18-10-11-28-20-7-6-16(23)12-17(18)20/h2-7,12-13,18H,8-11H2,1H3,(H,25,26)