N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-[(2R)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-[(2R)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-[(2R)-3-keto-2-methyl-1,4-benzoxazin-4-yl]propionamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

C[C@@H]1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H21N3O3S/c1-16-25(30)28(20-11-5-6-12-21(20)31-16)15-14-23(29)26-18-9-3-2-8-17(18)24-27-19-10-4-7-13-22(19)32-24/h2-13,16H,14-15H2,1H3,(H,26,29)/t16-/m1/s1