4-(1-benzofuran-5-ylamino)-2-butyl-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one

Systemtic Name: 4-(1-benzofuran-5-ylamino)-2-butyl-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one Openeye Name: 4-(benzofuran-5-ylamino)-2-butyl-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 4-(5-benzofuranylamino)-2-butyl-1,1-dioxo-5-phenyl-3-isothiazolone IUPAC Name: 4-(1-benzofuran-5-ylamino)-2-butyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 4-(benzofuran-5-ylamino)-2-butyl-1,1-diketo-5-phenyl-isothiazol-3-one Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CC4=C(C=C3)OC=C4

Isomeric SMILES

CCCCN1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NC3=CC4=C(C=C3)OC=C4

InChI

InChI=1S/C21H20N2O4S/c1-2-3-12-23-21(24)19(20(28(23,25)26)15-7-5-4-6-8-15)22-17-9-10-18-16(14-17)11-13-27-18/h4-11,13-14,22H,2-3,12H2,1H3