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

Systemtic Name: methyl (6R)-6-tert-butyl-2-[(5-propylthiophen-3-yl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl (6R)-6-tert-butyl-2-[(5-propylthiophene-3-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6R)-6-tert-butyl-2-[[oxo-(5-propyl-3-thiophenyl)methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl (6R)-6-tert-butyl-2-[(5-propylthiophene-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6R)-6-tert-butyl-2-[(5-propylthiophene-3-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C22H29NO3S2 MolecularWeight: 419.60056

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CS1)C(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)OC

Isomeric SMILES

CCCC1=CC(=CS1)C(=O)NC2=C(C3=C(S2)C[C@@H](CC3)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C22H29NO3S2/c1-6-7-15-10-13(12-27-15)19(24)23-20-18(21(25)26-5)16-9-8-14(22(2,3)4)11-17(16)28-20/h10,12,14H,6-9,11H2,1-5H3,(H,23,24)/t14-/m1/s1