6-tert-butyl-4-(2,5-dimethoxyphenyl)-N-(3-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 6-tert-butyl-4-(2,5-dimethoxyphenyl)-N-(3-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 6-tert-butyl-4-(2,5-dimethoxyphenyl)-N-(3-nitrophenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 6-tert-butyl-4-(2,5-dimethoxyphenyl)-N-(3-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 6-tert-butyl-4-(2,5-dimethoxyphenyl)-N-(3-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 6-tert-butyl-4-(2,5-dimethoxyphenyl)-N-(3-nitrophenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C23H26N4O5S MolecularWeight: 470.54134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(NC(=S)N1)C2=C(C=CC(=C2)OC)OC)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=C(C(NC(=S)N1)C2=C(C=CC(=C2)OC)OC)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O5S/c1-23(2,3)20-18(21(28)24-13-7-6-8-14(11-13)27(29)30)19(25-22(33)26-20)16-12-15(31-4)9-10-17(16)32-5/h6-12,19H,1-5H3,(H,24,28)(H2,25,26,33)