N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanamide

Systemtic Name: N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanamide Openeye Name: N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-7-(5-methyl-2-thienyl)-4,7-dioxo-heptanamide CAS Name: N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-7-(5-methyl-2-thiophenyl)-4,7-dioxoheptanamide IUPAC Name: N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-7-(5-methylthiophen-2-yl)-4,7-dioxoheptanamide Traditional Name: 4,7-diketo-N-(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)-7-(5-methyl-2-thienyl)enanthamide Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCC(=O)CCC(=O)C3=CC=C(S3)C

Isomeric SMILES

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CCC(=O)CCC(=O)C3=CC=C(S3)C

InChI

InChI=1S/C21H22N2O5S/c1-12-3-9-19(29-12)17(25)7-5-15(24)6-10-20(26)22-14-4-8-18-16(11-14)23-21(27)13(2)28-18/h3-4,8-9,11,13H,5-7,10H2,1-2H3,(H,22,26)(H,23,27)