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

Systemtic Name: 2-tert-butyl-1,1-bis(oxidanylidene)-5-phenyl-4-[(phenylmethyl)amino]-1,2-thiazol-3-one Openeye Name: 4-(benzylamino)-2-tert-butyl-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 2-tert-butyl-1,1-dioxo-5-phenyl-4-[(phenylmethyl)amino]-3-isothiazolone IUPAC Name: 4-(benzylamino)-2-tert-butyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 4-(benzylamino)-2-tert-butyl-1,1-diketo-5-phenyl-isothiazol-3-one Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NCC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3S/c1-20(2,3)22-19(23)17(21-14-15-10-6-4-7-11-15)18(26(22,24)25)16-12-8-5-9-13-16/h4-13,21H,14H2,1-3H3