1-[3-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-methoxy-phenyl]-1,3-diazinane-2,4-dione

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-methoxy-phenyl]-1,3-diazinane-2,4-dione Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-methoxy-phenyl]hexahydropyrimidine-2,4-dione CAS Name: 1-[3-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-methoxyphenyl]-1,3-diazinane-2,4-dione IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-methoxyphenyl]-1,3-diazinane-2,4-dione Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)-5-tert-butyl-4-methoxy-phenyl]-5,6-dihydrouracil Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC(=C1)N2CCC(=O)NC2=O)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

CC(C)(C)C1=C(C(=CC(=C1)N2CCC(=O)NC2=O)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C22H23N3O3S/c1-22(2,3)15-12-13(25-10-9-18(26)24-21(25)27)11-14(19(15)28-4)20-23-16-7-5-6-8-17(16)29-20/h5-8,11-12H,9-10H2,1-4H3,(H,24,26,27)