N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methyl-2-phenyl-thiazole-5-carboxamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-4-methyl-2-phenyl-5-thiazolecarboxamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-methyl-2-phenyl-thiazole-5-carboxamide Formula: C23H27N5O2S MolecularWeight: 437.55778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NCCOC3=NC=NC(=C3)N4CCCCCC4

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NCCOC3=NC=NC(=C3)N4CCCCCC4

InChI

InChI=1S/C23H27N5O2S/c1-17-21(31-23(27-17)18-9-5-4-6-10-18)22(29)24-11-14-30-20-15-19(25-16-26-20)28-12-7-2-3-8-13-28/h4-6,9-10,15-16H,2-3,7-8,11-14H2,1H3,(H,24,29)