(5S)-N-(2-azanyl-2-oxidanylidene-ethyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: (5S)-N-(2-azanyl-2-oxidanylidene-ethyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-N-(2-amino-2-oxo-ethyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-N-(2-amino-2-oxoethyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-N-(2-amino-2-oxoethyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-N-(2-amino-2-keto-ethyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NCC(=O)N

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NCC(=O)N

InChI

InChI=1S/C12H16N2O2S/c1-7-2-3-9-8(4-7)5-10(17-9)12(16)14-6-11(13)15/h5,7H,2-4,6H2,1H3,(H2,13,15)(H,14,16)/t7-/m0/s1