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

Systemtic Name: 2-butyl-1,1-bis(oxidanylidene)-5-phenyl-4-[(4-phenylmethoxyphenyl)amino]-1,2-thiazol-3-one Openeye Name: 4-(4-benzyloxyanilino)-2-butyl-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 2-butyl-1,1-dioxo-5-phenyl-4-(4-phenylmethoxyanilino)-3-isothiazolone IUPAC Name: 2-butyl-1,1-dioxo-5-phenyl-4-(4-phenylmethoxyanilino)-1,2-thiazol-3-one Traditional Name: 4-(4-benzoxyanilino)-2-butyl-1,1-diketo-5-phenyl-isothiazol-3-one Formula: C26H26N2O4S MolecularWeight: 462.56064

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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)OCC4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O4S/c1-2-3-18-28-26(29)24(25(33(28,30)31)21-12-8-5-9-13-21)27-22-14-16-23(17-15-22)32-19-20-10-6-4-7-11-20/h4-17,27H,2-3,18-19H2,1H3