2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanone Openeye Name: 1-(4-benzyl-1,4-diazepan-1-yl)-2-[5-methyl-2-(2-thienyl)oxazol-4-yl]ethanone CAS Name: 2-(5-methyl-2-thiophen-2-yl-4-oxazolyl)-1-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-(4-benzyl-1,4-diazepan-1-yl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanone Traditional Name: 1-(4-benzyl-1,4-diazepan-1-yl)-2-[5-methyl-2-(2-thienyl)oxazol-4-yl]ethanone Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CS2)CC(=O)N3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CS2)CC(=O)N3CCCN(CC3)CC4=CC=CC=C4

InChI

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