(6S)-2-acetamido-6-tert-butyl-N-(4-ethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: (6S)-2-acetamido-6-tert-butyl-N-(4-ethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: (6S)-2-acetamido-6-tert-butyl-N-(4-ethoxyphenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: (6S)-2-acetamido-6-tert-butyl-N-(4-ethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: (6S)-2-acetamido-6-tert-butyl-N-(4-ethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: (6S)-2-acetamido-6-tert-butyl-N-p-phenetyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C(C)(C)C)NC(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CC[C@@H](C3)C(C)(C)C)NC(=O)C

InChI

InChI=1S/C23H30N2O3S/c1-6-28-17-10-8-16(9-11-17)25-21(27)20-18-12-7-15(23(3,4)5)13-19(18)29-22(20)24-14(2)26/h8-11,15H,6-7,12-13H2,1-5H3,(H,24,26)(H,25,27)/t15-/m0/s1