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

Systemtic Name: N-[2-(azepan-1-yl)-2-phenyl-ethyl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-phenyl-ethyl]-2-methyl-5-phenyl-thiazole-4-carboxamide CAS Name: N-[2-(1-azepanyl)-2-phenylethyl]-2-methyl-5-phenyl-4-thiazolecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-phenylethyl]-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-phenyl-ethyl]-2-methyl-5-phenyl-thiazole-4-carboxamide Formula: C25H29N3OS MolecularWeight: 419.58226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C2=CC=CC=C2)C(=O)NCC(C3=CC=CC=C3)N4CCCCCC4

Isomeric SMILES

CC1=NC(=C(S1)C2=CC=CC=C2)C(=O)NCC(C3=CC=CC=C3)N4CCCCCC4

InChI

InChI=1S/C25H29N3OS/c1-19-27-23(24(30-19)21-14-8-5-9-15-21)25(29)26-18-22(20-12-6-4-7-13-20)28-16-10-2-3-11-17-28/h4-9,12-15,22H,2-3,10-11,16-18H2,1H3,(H,26,29)