2-methyl-N-[5-[2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]-1,3-benzothiazol-2-yl]propanamide

Systemtic Name: 2-methyl-N-[5-[2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]-1,3-benzothiazol-2-yl]propanamide Openeye Name: 2-methyl-N-[5-[[2-(3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]-1,3-benzothiazol-2-yl]propanamide CAS Name: 2-methyl-N-[5-[[1-oxo-2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]amino]-1,3-benzothiazol-2-yl]propanamide IUPAC Name: 2-methyl-N-[5-[[2-(3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]-1,3-benzothiazol-2-yl]propanamide Traditional Name: N-[5-[[2-(3-keto-1,4-benzoxazin-4-yl)acetyl]amino]-1,3-benzothiazol-2-yl]-2-methyl-propionamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)CN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

CC(C)C(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)CN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C21H20N4O4S/c1-12(2)20(28)24-21-23-14-9-13(7-8-17(14)30-21)22-18(26)10-25-15-5-3-4-6-16(15)29-11-19(25)27/h3-9,12H,10-11H2,1-2H3,(H,22,26)(H,23,24,28)