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ethyl 4-[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanoylamino]benzoate

ethyl 4-[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanoylamino]benzoate

Systemtic Name:ethyl 4-[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanoylamino]benzoate
Openeye Name:ethyl 4-[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanoylamino]benzoate
CAS Name:4-[[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-1-oxopropyl]amino]benzoic acid ethyl ester
IUPAC Name:ethyl 4-[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]propanoylamino]benzoate
Traditional Name:4-[2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]propanoylamino]benzoic acid ethyl ester
Formula: C23H25N3O3S
MolecularWeight: 423.5279
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(CC(CC3)C)C=C2C#N


Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(CC(CC3)C)C=C2C#N


InChI

InChI=1S/C23H25N3O3S/c1-4-29-23(28)16-6-8-19(9-7-16)25-21(27)15(3)30-22-18(13-24)12-17-11-14(2)5-10-20(17)26-22/h6-9,12,14-15H,4-5,10-11H2,1-3H3,(H,25,27)


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