N-[5-[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]-1,3-benzothiazol-2-yl]-2-methyl-propanamide

Systemtic Name: N-[5-[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]-1,3-benzothiazol-2-yl]-2-methyl-propanamide Openeye Name: N-[5-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]-1,3-benzothiazol-2-yl]-2-methyl-propanamide CAS Name: N-[5-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]-2-methylpropanamide IUPAC Name: N-[5-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]-1,3-benzothiazol-2-yl]-2-methylpropanamide Traditional Name: N-[5-[[2-(6-chloro-3-keto-1,4-benzoxazin-4-yl)acetyl]amino]-1,3-benzothiazol-2-yl]-2-methyl-propionamide Formula: C21H19ClN4O4S MolecularWeight: 458.91796

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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=C3C=C(C=C4)Cl

Isomeric SMILES

CC(C)C(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)CN3C(=O)COC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN4O4S/c1-11(2)20(29)25-21-24-14-8-13(4-6-17(14)31-21)23-18(27)9-26-15-7-12(22)3-5-16(15)30-10-19(26)28/h3-8,11H,9-10H2,1-2H3,(H,23,27)(H,24,25,29)