3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propan-1-one

Systemtic Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propan-1-one Openeye Name: 3-(3,5-dimethylisoxazol-4-yl)-1-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]propan-1-one CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)-1-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]-1-propanone IUPAC Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propan-1-one Traditional Name: 3-(3,5-dimethylisoxazol-4-yl)-1-[4-(2-thenyl)-1,4-diazepan-1-yl]propan-1-one Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC(=O)N2CCCN(CC2)CC3=CC=CS3

Isomeric SMILES

CC1=C(C(=NO1)C)CCC(=O)N2CCCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C18H25N3O2S/c1-14-17(15(2)23-19-14)6-7-18(22)21-9-4-8-20(10-11-21)13-16-5-3-12-24-16/h3,5,12H,4,6-11,13H2,1-2H3