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

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H21N3O3S/c1-27-11-8-16(19-21-14-4-2-3-5-15(14)22-19)23-20(24)13-6-7-17-18(12-13)26-10-9-25-17/h2-7,12,16H,8-11H2,1H3,(H,21,22)(H,23,24)