2-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)ethanamide

Systemtic Name: 2-[(2S)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)ethanamide Openeye Name: 2-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)acetamide CAS Name: 2-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-[2-(1-pyrrolidinyl)-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-[(2S)-3-keto-2-methyl-1,4-benzoxazin-4-yl]-N-(2-pyrrolidino-1,3-benzothiazol-6-yl)acetamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CC(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCCC5

Isomeric SMILES

C[C@H]1C(=O)N(C2=CC=CC=C2O1)CC(=O)NC3=CC4=C(C=C3)N=C(S4)N5CCCC5

InChI

InChI=1S/C22H22N4O3S/c1-14-21(28)26(17-6-2-3-7-18(17)29-14)13-20(27)23-15-8-9-16-19(12-15)30-22(24-16)25-10-4-5-11-25/h2-3,6-9,12,14H,4-5,10-11,13H2,1H3,(H,23,27)/t14-/m0/s1