1,3-ditert-butyl-5-phenyl-5-pyridin-2-yl-1,3-diazinane-4-thione

Systemtic Name: 1,3-ditert-butyl-5-phenyl-5-pyridin-2-yl-1,3-diazinane-4-thione Openeye Name: 1,3-ditert-butyl-5-phenyl-5-(2-pyridyl)hexahydropyrimidine-4-thione CAS Name: 1,3-ditert-butyl-5-phenyl-5-(2-pyridinyl)-1,3-diazinane-4-thione IUPAC Name: 1,3-ditert-butyl-5-phenyl-5-pyridin-2-yl-1,3-diazinane-4-thione Traditional Name: 1,3-ditert-butyl-5-phenyl-5-(2-pyridyl)hexahydropyrimidine-4-thione Formula: C23H31N3S MolecularWeight: 381.57734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC(C(=S)N(C1)C(C)(C)C)(C2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

CC(C)(C)N1CC(C(=S)N(C1)C(C)(C)C)(C2=CC=CC=C2)C3=CC=CC=N3

InChI

InChI=1S/C23H31N3S/c1-21(2,3)25-16-23(18-12-8-7-9-13-18,19-14-10-11-15-24-19)20(27)26(17-25)22(4,5)6/h7-15H,16-17H2,1-6H3