propan-2-yl 2-[[3,4-bis(chloranyl)-1-benzothiophen-2-yl]carbonylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[[3,4-bis(chloranyl)-1-benzothiophen-2-yl]carbonylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Openeye Name: isopropyl 2-[(3,4-dichlorobenzothiophene-2-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate CAS Name: 2-[[(3,4-dichloro-1-benzothiophen-2-yl)-oxomethyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(3,4-dichloro-1-benzothiophene-2-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Traditional Name: 2-[(3,4-dichlorobenzothiophene-2-carbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid isopropyl ester Formula: C22H21Cl2NO3S2 MolecularWeight: 482.44304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=C(C4=C(S3)C=CC=C4Cl)Cl

Isomeric SMILES

CC(C)OC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=C(C4=C(S3)C=CC=C4Cl)Cl

InChI

InChI=1S/C22H21Cl2NO3S2/c1-11(2)28-22(27)16-12-7-4-3-5-9-14(12)30-21(16)25-20(26)19-18(24)17-13(23)8-6-10-15(17)29-19/h6,8,10-11H,3-5,7,9H2,1-2H3,(H,25,26)