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

Systemtic Name: 2-butyl-4-[(2,5-diethoxy-4-morpholin-4-yl-phenyl)amino]-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one Openeye Name: 2-butyl-4-(2,5-diethoxy-4-morpholino-anilino)-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 2-butyl-4-[2,5-diethoxy-4-(4-morpholinyl)anilino]-1,1-dioxo-5-phenyl-3-isothiazolone IUPAC Name: 2-butyl-4-(2,5-diethoxy-4-morpholin-4-ylanilino)-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 2-butyl-4-(2,5-diethoxy-4-morpholino-anilino)-1,1-diketo-5-phenyl-isothiazol-3-one Formula: C27H35N3O6S MolecularWeight: 529.6483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=C(C=C(C(=C3)OCC)N4CCOCC4)OCC

Isomeric SMILES

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=C(C=C(C(=C3)OCC)N4CCOCC4)OCC

InChI

InChI=1S/C27H35N3O6S/c1-4-7-13-30-27(31)25(26(37(30,32)33)20-11-9-8-10-12-20)28-21-18-24(36-6-3)22(19-23(21)35-5-2)29-14-16-34-17-15-29/h8-12,18-19,28H,4-7,13-17H2,1-3H3