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methyl 8-(1H-benzimidazol-2-ylsulfinylmethyl)-1-ethyl-3,4-dihydro-2H-quinoline-3-carboxylate

methyl 8-(1H-benzimidazol-2-ylsulfinylmethyl)-1-ethyl-3,4-dihydro-2H-quinoline-3-carboxylate

Systemtic Name:methyl 8-(1H-benzimidazol-2-ylsulfinylmethyl)-1-ethyl-3,4-dihydro-2H-quinoline-3-carboxylate
Openeye Name:methyl 8-(1H-benzimidazol-2-ylsulfinylmethyl)-1-ethyl-3,4-dihydro-2H-quinoline-3-carboxylate
CAS Name:8-(1H-benzimidazol-2-ylsulfinylmethyl)-1-ethyl-3,4-dihydro-2H-quinoline-3-carboxylic acid methyl ester
IUPAC Name:methyl 8-(1H-benzimidazol-2-ylsulfinylmethyl)-1-ethyl-3,4-dihydro-2H-quinoline-3-carboxylate
Traditional Name:8-(1H-benzimidazol-2-ylsulfinylmethyl)-1-ethyl-3,4-dihydro-2H-quinoline-3-carboxylic acid methyl ester
Formula: C21H23N3O3S
MolecularWeight: 397.49062
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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CC2=C1C(=CC=C2)CS(=O)C3=NC4=CC=CC=C4N3)C(=O)OC


Isomeric SMILES

CCN1CC(CC2=C1C(=CC=C2)CS(=O)C3=NC4=CC=CC=C4N3)C(=O)OC


InChI

InChI=1S/C21H23N3O3S/c1-3-24-12-16(20(25)27-2)11-14-7-6-8-15(19(14)24)13-28(26)21-22-17-9-4-5-10-18(17)23-21/h4-10,16H,3,11-13H2,1-2H3,(H,22,23)


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