naphthalen-2-yl 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate

Systemtic Name: naphthalen-2-yl 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate Openeye Name: 2-naphthyl 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate CAS Name: 1-(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)-4-piperidinecarboxylic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate Traditional Name: 1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)isonipecotic acid 2-naphthyl ester Formula: C24H23N3O2S MolecularWeight: 417.52332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCC(CC3)C(=O)OC4=CC5=CC=CC=C5C=C4)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCC(CC3)C(=O)OC4=CC5=CC=CC=C5C=C4)C

InChI

InChI=1S/C24H23N3O2S/c1-15-16(2)30-23-21(15)22(25-14-26-23)27-11-9-18(10-12-27)24(28)29-20-8-7-17-5-3-4-6-19(17)13-20/h3-8,13-14,18H,9-12H2,1-2H3