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

Systemtic Name: 1-[4-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[4-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]-1,4-diazepan-1-yl]ethanone CAS Name: 1-[4-[(5-methyl-2-thiophen-2-yl-4-oxazolyl)methyl]-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-[4-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]-1,4-diazepan-1-yl]ethanone Traditional Name: 1-[4-[[5-methyl-2-(2-thienyl)oxazol-4-yl]methyl]-1,4-diazepan-1-yl]ethanone Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CS2)CN3CCCN(CC3)C(=O)C

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CS2)CN3CCCN(CC3)C(=O)C

InChI

InChI=1S/C16H21N3O2S/c1-12-14(17-16(21-12)15-5-3-10-22-15)11-18-6-4-7-19(9-8-18)13(2)20/h3,5,10H,4,6-9,11H2,1-2H3