N-(2-adamantylideneamino)-2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(2-adamantylideneamino)-2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(2-adamantylideneamino)-2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(2-adamantylideneamino)-2-methyl-6-phenyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(2-adamantylideneamino)-2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (2-adamantylideneamino)-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)amine Formula: C23H24N4S MolecularWeight: 388.52846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C=C(SC2=N1)C3=CC=CC=C3)NN=C4C5CC6CC(C5)CC4C6

Isomeric SMILES

CC1=NC(=C2C=C(SC2=N1)C3=CC=CC=C3)NN=C4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C23H24N4S/c1-13-24-22(19-12-20(28-23(19)25-13)16-5-3-2-4-6-16)27-26-21-17-8-14-7-15(10-17)11-18(21)9-14/h2-6,12,14-15,17-18H,7-11H2,1H3,(H,24,25,27)