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

Systemtic Name: (5S)-5-methyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-5-methyl-N-(4-pyridylmethyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-5-methyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-5-methyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-5-methyl-N-(4-pyridylmethyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C16H18N2OS MolecularWeight: 286.39192

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC=NC=C3

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C16H18N2OS/c1-11-2-3-14-13(8-11)9-15(20-14)16(19)18-10-12-4-6-17-7-5-12/h4-7,9,11H,2-3,8,10H2,1H3,(H,18,19)/t11-/m0/s1