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

Systemtic Name: (5S)-N-[(3-aminocarbonylphenyl)methyl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-N-[(3-carbamoylphenyl)methyl]-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-N-[(3-carbamoylphenyl)methyl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-N-[(3-carbamoylphenyl)methyl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-N-(3-carbamoylbenzyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O2S/c1-11-5-6-15-14(7-11)9-16(23-15)18(22)20-10-12-3-2-4-13(8-12)17(19)21/h2-4,8-9,11H,5-7,10H2,1H3,(H2,19,21)(H,20,22)/t11-/m0/s1