3-[[4-(3,4-dimethyl-2-oxidanylidene-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-[[4-(3,4-dimethyl-2-oxidanylidene-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-[[4-(3,4-dimethyl-2-oxo-thiazol-5-yl)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[4-(3,4-dimethyl-2-oxo-5-thiazolyl)-2-pyrimidinyl]amino]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-[[4-(3,4-dimethyl-2-oxo-1,3-thiazol-5-yl)pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: N-benzyl-3-[[4-(2-keto-3,4-dimethyl-4-thiazolin-5-yl)pyrimidin-2-yl]amino]benzenesulfonamide Formula: C22H21N5O3S2 MolecularWeight: 467.56384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=O)N1C)C2=NC(=NC=C2)NC3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=O)N1C)C2=NC(=NC=C2)NC3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H21N5O3S2/c1-15-20(31-22(28)27(15)2)19-11-12-23-21(26-19)25-17-9-6-10-18(13-17)32(29,30)24-14-16-7-4-3-5-8-16/h3-13,24H,14H2,1-2H3,(H,23,25,26)