(2S)-N-methyl-4-[2-(4-methylphenyl)sulfanylethanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-N-methyl-4-[2-(4-methylphenyl)sulfanylethanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-N-methyl-4-[2-(p-tolylsulfanyl)acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-N-methyl-4-[2-[(4-methylphenyl)thio]-1-oxoethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-N-methyl-4-[2-(4-methylphenyl)sulfanylacetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-N-methyl-4-[2-(p-tolylthio)acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)N2CC(OC3=CC=CC=C32)C(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N2C[C@H](OC3=CC=CC=C32)C(=O)NC

InChI

InChI=1S/C19H20N2O3S/c1-13-7-9-14(10-8-13)25-12-18(22)21-11-17(19(23)20-2)24-16-6-4-3-5-15(16)21/h3-10,17H,11-12H2,1-2H3,(H,20,23)/t17-/m0/s1