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

Systemtic Name: (5S)-N-(3,4-dimethoxyphenyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-N-(3,4-dimethoxyphenyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-N-(3,4-dimethoxyphenyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-N-(3,4-dimethoxyphenyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-N-(3,4-dimethoxyphenyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C18H21NO3S/c1-11-4-7-16-12(8-11)9-17(23-16)18(20)19-13-5-6-14(21-2)15(10-13)22-3/h5-6,9-11H,4,7-8H2,1-3H3,(H,19,20)/t11-/m0/s1