N-[5-(azepan-1-ylmethyl)-4-phenyl-1,3-thiazol-2-yl]benzamide

Systemtic Name: N-[5-(azepan-1-ylmethyl)-4-phenyl-1,3-thiazol-2-yl]benzamide Openeye Name: N-[5-(azepan-1-ylmethyl)-4-phenyl-thiazol-2-yl]benzamide CAS Name: N-[5-(1-azepanylmethyl)-4-phenyl-2-thiazolyl]benzamide IUPAC Name: N-[5-(azepan-1-ylmethyl)-4-phenyl-1,3-thiazol-2-yl]benzamide Traditional Name: N-[5-(azepan-1-ylmethyl)-4-phenyl-thiazol-2-yl]benzamide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=C(N=C(S2)NC(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CC2=C(N=C(S2)NC(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3OS/c27-22(19-13-7-4-8-14-19)25-23-24-21(18-11-5-3-6-12-18)20(28-23)17-26-15-9-1-2-10-16-26/h3-8,11-14H,1-2,9-10,15-17H2,(H,24,25,27)