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

Systemtic Name: (2R)-4-[2-(2-methylphenyl)sulfanylethanoyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-4-[2-(o-tolylsulfanyl)acetyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-4-[2-[(2-methylphenyl)thio]-1-oxoethyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-4-[2-(2-methylphenyl)sulfanylacetyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-4-[2-(o-tolylthio)acetyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)CSC3=CC=CC=C3C

Isomeric SMILES

CCCNC(=O)[C@H]1CN(C2=CC=CC=C2O1)C(=O)CSC3=CC=CC=C3C

InChI

InChI=1S/C21H24N2O3S/c1-3-12-22-21(25)18-13-23(16-9-5-6-10-17(16)26-18)20(24)14-27-19-11-7-4-8-15(19)2/h4-11,18H,3,12-14H2,1-2H3,(H,22,25)/t18-/m1/s1