N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-6-chloro-chromane-3-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-6-chloro-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-6-chloro-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-6-chloro-chroman-3-carboxamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3CC4=C(C=CC(=C4)Cl)OC3

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3CC4=C(C=CC(=C4)Cl)OC3

InChI

InChI=1S/C21H22ClN3O2S/c1-28-9-8-18(20-23-16-4-2-3-5-17(16)24-20)25-21(26)14-10-13-11-15(22)6-7-19(13)27-12-14/h2-7,11,14,18H,8-10,12H2,1H3,(H,23,24)(H,25,26)