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

Systemtic Name: (5S)-5-methyl-N-(2-methylsulfanylphenyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide Openeye Name: (5S)-5-methyl-N-(2-methylsulfanylphenyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide CAS Name: (5S)-5-methyl-N-[2-(methylthio)phenyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide IUPAC Name: (5S)-5-methyl-N-(2-methylsulfanylphenyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide Traditional Name: (5S)-5-methyl-N-[2-(methylthio)phenyl]-4,5,6,7-tetrahydroindoxazene-3-carboxamide Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=NO2)C(=O)NC3=CC=CC=C3SC

Isomeric SMILES

C[C@H]1CCC2=C(C1)C(=NO2)C(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C16H18N2O2S/c1-10-7-8-13-11(9-10)15(18-20-13)16(19)17-12-5-3-4-6-14(12)21-2/h3-6,10H,7-9H2,1-2H3,(H,17,19)/t10-/m0/s1