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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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