2-butyl-4-[[4-(hydroxymethyl)phenyl]amino]-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one

Systemtic Name: 2-butyl-4-[[4-(hydroxymethyl)phenyl]amino]-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one Openeye Name: 2-butyl-4-[4-(hydroxymethyl)anilino]-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 2-butyl-4-[4-(hydroxymethyl)anilino]-1,1-dioxo-5-phenyl-3-isothiazolone IUPAC Name: 2-butyl-4-[4-(hydroxymethyl)anilino]-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 2-butyl-1,1-diketo-4-(4-methylolanilino)-5-phenyl-isothiazol-3-one Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CC=C(C=C3)CO

Isomeric SMILES

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CC=C(C=C3)CO

InChI

InChI=1S/C20H22N2O4S/c1-2-3-13-22-20(24)18(21-17-11-9-15(14-23)10-12-17)19(27(22,25)26)16-7-5-4-6-8-16/h4-12,21,23H,2-3,13-14H2,1H3