(6S)-2-(2-bromanylethanoylamino)-N-(2-ethoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: (6S)-2-(2-bromanylethanoylamino)-N-(2-ethoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: (6S)-2-[(2-bromoacetyl)amino]-N-(2-ethoxyphenyl)-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: (6S)-2-[(2-bromo-1-oxoethyl)amino]-N-(2-ethoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: (6S)-2-[(2-bromoacetyl)amino]-N-(2-ethoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: (6S)-2-[(2-bromoacetyl)amino]-6-methyl-N-o-phenetyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H23BrN2O3S MolecularWeight: 451.37722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCC(C3)C)NC(=O)CBr

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2=C(SC3=C2CC[C@@H](C3)C)NC(=O)CBr

InChI

InChI=1S/C20H23BrN2O3S/c1-3-26-15-7-5-4-6-14(15)22-19(25)18-13-9-8-12(2)10-16(13)27-20(18)23-17(24)11-21/h4-7,12H,3,8-11H2,1-2H3,(H,22,25)(H,23,24)/t12-/m0/s1