6-(1-adamantyl)-N-phenyl-thieno[3,2-d]pyrimidin-4-amine

Systemtic Name: 6-(1-adamantyl)-N-phenyl-thieno[3,2-d]pyrimidin-4-amine Openeye Name: 6-(1-adamantyl)-N-phenyl-thieno[3,2-d]pyrimidin-4-amine CAS Name: 6-(1-adamantyl)-N-phenyl-4-thieno[3,2-d]pyrimidinamine IUPAC Name: 6-(1-adamantyl)-N-phenylthieno[3,2-d]pyrimidin-4-amine Traditional Name: [6-(1-adamantyl)thieno[3,2-d]pyrimidin-4-yl]-phenyl-amine Formula: C22H23N3S MolecularWeight: 361.50312

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(S4)C(=NC=N5)NC6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(S4)C(=NC=N5)NC6=CC=CC=C6

InChI

InChI=1S/C22H23N3S/c1-2-4-17(5-3-1)25-21-20-18(23-13-24-21)9-19(26-20)22-10-14-6-15(11-22)8-16(7-14)12-22/h1-5,9,13-16H,6-8,10-12H2,(H,23,24,25)