(5S)-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N,5-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: (5S)-N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N,5-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-N-[(5-bromo-2-methoxy-phenyl)methyl]-N,5-dimethyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-N-[(5-bromo-2-methoxyphenyl)methyl]-N,5-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-N-[(5-bromo-2-methoxyphenyl)methyl]-N,5-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-N-(5-bromo-2-methoxy-benzyl)-N,5-dimethyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C19H22BrNO2S MolecularWeight: 408.35248

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)N(C)CC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)N(C)CC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C19H22BrNO2S/c1-12-4-7-17-13(8-12)10-18(24-17)19(22)21(2)11-14-9-15(20)5-6-16(14)23-3/h5-6,9-10,12H,4,7-8,11H2,1-3H3/t12-/m0/s1