3-[(2R)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]propanamide

Systemtic Name: 3-[(2R)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]propanamide Openeye Name: 3-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[2-(3-thienylmethylsulfanyl)ethyl]propanamide CAS Name: 3-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[2-(3-thiophenylmethylthio)ethyl]propanamide IUPAC Name: 3-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]propanamide Traditional Name: 3-[(2R)-3-keto-2-methyl-1,4-benzoxazin-4-yl]-N-[2-(3-thenylthio)ethyl]propionamide Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCCSCC3=CSC=C3

Isomeric SMILES

C[C@@H]1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NCCSCC3=CSC=C3

InChI

InChI=1S/C19H22N2O3S2/c1-14-19(23)21(16-4-2-3-5-17(16)24-14)9-6-18(22)20-8-11-26-13-15-7-10-25-12-15/h2-5,7,10,12,14H,6,8-9,11,13H2,1H3,(H,20,22)/t14-/m1/s1