4-[2-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 4-[2-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 4-[2-[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[2-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 4-[2-[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-2-keto-ethyl]-1,4-benzoxazin-3-one Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CN2C(=O)COC3=CC=CC=C32)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)CN2C(=O)COC3=CC=CC=C32)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H19N3O3S/c25-19(12-24-15-7-2-3-9-17(15)27-13-20(24)26)23-11-5-8-16(23)21-22-14-6-1-4-10-18(14)28-21/h1-4,6-7,9-10,16H,5,8,11-13H2/t16-/m1/s1