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

Systemtic Name: 1-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)ethanone Openeye Name: 1-[4-(2-furylmethyl)-1,4-diazepan-1-yl]-2-(5-methyl-2-phenyl-thiazol-4-yl)ethanone CAS Name: 1-[4-(2-furanylmethyl)-1,4-diazepan-1-yl]-2-(5-methyl-2-phenyl-4-thiazolyl)ethanone IUPAC Name: 1-[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)ethanone Traditional Name: 1-[4-(2-furfuryl)-1,4-diazepan-1-yl]-2-(5-methyl-2-phenyl-thiazol-4-yl)ethanone Formula: C22H25N3O2S MolecularWeight: 395.5178

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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=CO4

Isomeric SMILES

CC1=C(N=C(S1)C2=CC=CC=C2)CC(=O)N3CCCN(CC3)CC4=CC=CO4

InChI

InChI=1S/C22H25N3O2S/c1-17-20(23-22(28-17)18-7-3-2-4-8-18)15-21(26)25-11-6-10-24(12-13-25)16-19-9-5-14-27-19/h2-5,7-9,14H,6,10-13,15-16H2,1H3