(6R)-2-azanyl-6-methyl-N-[(4-methylphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: (6R)-2-azanyl-6-methyl-N-[(4-methylphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: (6R)-2-amino-6-methyl-N-(p-tolylmethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: (6R)-2-amino-6-methyl-N-[(4-methylphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: (6R)-2-amino-6-methyl-N-[(4-methylphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: (6R)-2-amino-6-methyl-N-(4-methylbenzyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=C(C=C3)C)N

Isomeric SMILES

C[C@@H]1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=C(C=C3)C)N

InChI

InChI=1S/C18H22N2OS/c1-11-3-6-13(7-4-11)10-20-18(21)16-14-8-5-12(2)9-15(14)22-17(16)19/h3-4,6-7,12H,5,8-10,19H2,1-2H3,(H,20,21)/t12-/m1/s1