ethyl (6R)-6-tert-butyl-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl (6R)-6-tert-butyl-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl (6R)-6-tert-butyl-2-[(3-chlorobenzothiophene-2-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6R)-6-tert-butyl-2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl (6R)-6-tert-butyl-2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6R)-6-tert-butyl-2-[(3-chlorobenzothiophene-2-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C24H26ClNO3S2 MolecularWeight: 476.05114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C(C)(C)C)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CC[C@H](C2)C(C)(C)C)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C24H26ClNO3S2/c1-5-29-23(28)18-14-11-10-13(24(2,3)4)12-17(14)31-22(18)26-21(27)20-19(25)15-8-6-7-9-16(15)30-20/h6-9,13H,5,10-12H2,1-4H3,(H,26,27)/t13-/m1/s1