2-butyl-5-[[2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]carbonyl]isoindole-1,3-dione

Systemtic Name: 2-butyl-5-[[2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]carbonyl]isoindole-1,3-dione Openeye Name: 2-butyl-5-[2-(2-isopropylphenyl)imino-1,3-thiazinane-3-carbonyl]isoindoline-1,3-dione CAS Name: 2-butyl-5-[oxo-[2-(2-propan-2-ylphenyl)imino-1,3-thiazinan-3-yl]methyl]isoindole-1,3-dione IUPAC Name: 2-butyl-5-[2-(2-propan-2-ylphenyl)imino-1,3-thiazinane-3-carbonyl]isoindole-1,3-dione Traditional Name: 2-butyl-5-(2-o-cumenylimino-1,3-thiazinane-3-carbonyl)isoindoline-1,3-quinone Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCCSC3=NC4=CC=CC=C4C(C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCCSC3=NC4=CC=CC=C4C(C)C

InChI

InChI=1S/C26H29N3O3S/c1-4-5-13-28-24(31)20-12-11-18(16-21(20)25(28)32)23(30)29-14-8-15-33-26(29)27-22-10-7-6-9-19(22)17(2)3/h6-7,9-12,16-17H,4-5,8,13-15H2,1-3H3