N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)propanamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)propanamide Openeye Name: 3-(3-ethyl-2-oxo-benzimidazol-1-yl)-N-thiochroman-4-yl-propanamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(3-ethyl-2-oxo-1-benzimidazolyl)propanamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-3-(3-ethyl-2-oxobenzimidazol-1-yl)propanamide Traditional Name: 3-(3-ethyl-2-keto-benzimidazol-1-yl)-N-thiochroman-4-yl-propionamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)CCC(=O)NC3CCSC4=CC=CC=C34

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)CCC(=O)NC3CCSC4=CC=CC=C34

InChI

InChI=1S/C21H23N3O2S/c1-2-23-17-8-4-5-9-18(17)24(21(23)26)13-11-20(25)22-16-12-14-27-19-10-6-3-7-15(16)19/h3-10,16H,2,11-14H2,1H3,(H,22,25)