2-(2,5-dimethyl-1,3-thiazol-4-yl)-1-[4-(6-naphthalen-2-ylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-(2,5-dimethyl-1,3-thiazol-4-yl)-1-[4-(6-naphthalen-2-ylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanone Openeye Name: 2-(2,5-dimethylthiazol-4-yl)-1-[4-[6-(2-naphthyl)pyrimidin-4-yl]-1,4-diazepan-1-yl]ethanone CAS Name: 2-(2,5-dimethyl-4-thiazolyl)-1-[4-[6-(2-naphthalenyl)-4-pyrimidinyl]-1,4-diazepan-1-yl]ethanone IUPAC Name: 2-(2,5-dimethyl-1,3-thiazol-4-yl)-1-[4-(6-naphthalen-2-ylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanone Traditional Name: 2-(2,5-dimethylthiazol-4-yl)-1-[4-[6-(2-naphthyl)pyrimidin-4-yl]-1,4-diazepan-1-yl]ethanone Formula: C26H27N5OS MolecularWeight: 457.59048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C)CC(=O)N2CCCN(CC2)C3=NC=NC(=C3)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=C(N=C(S1)C)CC(=O)N2CCCN(CC2)C3=NC=NC(=C3)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H27N5OS/c1-18-23(29-19(2)33-18)16-26(32)31-11-5-10-30(12-13-31)25-15-24(27-17-28-25)22-9-8-20-6-3-4-7-21(20)14-22/h3-4,6-9,14-15,17H,5,10-13,16H2,1-2H3