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methyl 3-chloranyl-6-[3-(5-methylpyrazol-1-yl)propanoylamino]-1-benzothiophene-2-carboxylate

methyl 3-chloranyl-6-[3-(5-methylpyrazol-1-yl)propanoylamino]-1-benzothiophene-2-carboxylate

Systemtic Name:methyl 3-chloranyl-6-[3-(5-methylpyrazol-1-yl)propanoylamino]-1-benzothiophene-2-carboxylate
Openeye Name:methyl 3-chloro-6-[3-(5-methylpyrazol-1-yl)propanoylamino]benzothiophene-2-carboxylate
CAS Name:3-chloro-6-[[3-(5-methyl-1-pyrazolyl)-1-oxopropyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester
IUPAC Name:methyl 3-chloro-6-[3-(5-methylpyrazol-1-yl)propanoylamino]-1-benzothiophene-2-carboxylate
Traditional Name:3-chloro-6-[3-(5-methylpyrazol-1-yl)propanoylamino]benzothiophene-2-carboxylic acid methyl ester
Formula: C17H16ClN3O3S
MolecularWeight: 377.84524
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1CCC(=O)NC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)Cl


Isomeric SMILES

CC1=CC=NN1CCC(=O)NC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)Cl


InChI

InChI=1S/C17H16ClN3O3S/c1-10-5-7-19-21(10)8-6-14(22)20-11-3-4-12-13(9-11)25-16(15(12)18)17(23)24-2/h3-5,7,9H,6,8H2,1-2H3,(H,20,22)


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