2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)-1-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)-1-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]ethanone Openeye Name: 2-(5-methyl-2-phenyl-thiazol-4-yl)-1-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]ethanone CAS Name: 2-(5-methyl-2-phenyl-4-thiazolyl)-1-[4-(3-pyridinylmethyl)-1,4-diazepan-1-yl]ethanone IUPAC Name: 2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)-1-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]ethanone Traditional Name: 2-(5-methyl-2-phenyl-thiazol-4-yl)-1-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]ethanone Formula: C23H26N4OS MolecularWeight: 406.54374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)C2=CC=CC=C2)CC(=O)N3CCCN(CC3)CC4=CN=CC=C4

Isomeric SMILES

CC1=C(N=C(S1)C2=CC=CC=C2)CC(=O)N3CCCN(CC3)CC4=CN=CC=C4

InChI

InChI=1S/C23H26N4OS/c1-18-21(25-23(29-18)20-8-3-2-4-9-20)15-22(28)27-12-6-11-26(13-14-27)17-19-7-5-10-24-16-19/h2-5,7-10,16H,6,11-15,17H2,1H3